Physical Chemistry, Chemical Physics

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  • 1999 | Journal Article
    ​ ​Häber, Thomas, Ulrich Schmitt, and Martin A. Suhm. "FTIR-spectroscopy of molecular clusters in pulsed supersonic slit-jet expansions​." ​Physical Chemistry, Chemical Physics ​1, no. 24 (1999): ​5573​-5582​. ​https://doi.org/10.1039/a907264k.
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  • 2000 | Journal Article
    ​ ​Raveendran, P., D. Zimmermann, T. Haber, and Martin A. Suhm. "Exploring a hydrogen-bond terminus: spectroscopy of eucalyptol-alcohol clusters​." ​Physical Chemistry Chemical Physics ​2, no. 16 (2000): ​3555​-3563​. ​https://doi.org/10.1039/b003024o.
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  • 2000 | Journal Article
    ​ ​Goos, E., H. Hippler, Karlheinz Hoyermann, and B. Jurges. "Laser powered homogeneous pyrolysis of butane initiated by methyl radicals in a quasi-wall-free reactor at 750-1000 K​." ​Physical Chemistry Chemical Physics ​2, no. 22 (2000): ​5127​-5132​. ​https://doi.org/10.1039/b005219l.
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  • 2000 | Journal Article
    ​ ​Dashevskaya, Elena I., Ilya Litvin, E. E. Nikitin, I. Oref, and Juergen Troe. "Classical diffusion model of vibrational predissociation of van der Waals complexes: truncated mean first passage time approximation​." ​Physical Chemistry Chemical Physics ​2, no. 10 (2000): ​2251​-2259​. ​https://doi.org/10.1039/a909894a.
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  • 2000 | Journal Article
    ​ ​Wittkopp, A., M. Prall, Peter R. Schreiner, and H. F. Schaefer. "Is SH4, the simplest 10-S-4 sulfurane, observable?​." ​Physical Chemistry Chemical Physics ​2, no. 10 (2000): ​2239​-2244​. ​https://doi.org/10.1039/b000597p.
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  • 2000 | Journal Article
    ​ ​Hahn, J., Klaus Luther, and Juergen Troe. "Experimental and theoretical study of the temperature and pressure dependences of the recombination reactions O+NO2(+M) -> NO3(+M) and NO2+NO3(+M) -> N2O5(+M)​." ​Physical Chemistry Chemical Physics ​2, no. 22 (2000): ​5098​-5104​. ​https://doi.org/10.1039/b005756h.
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  • 2000 | Journal Article
    ​ ​Harding, L. B., Juergen Troe, and Vladimir G. Ushakov. "Classical trajectory calculations of the high pressure limiting rate constants and of specific rate constants for the reaction H+O-2 -> HO2: dynamic isotope effects between tritium plus O-2 and muonium plus O-2​." ​Physical Chemistry Chemical Physics ​2, no. 4 (2000): ​631​-642​. ​https://doi.org/10.1039/a908929b.
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  • 2000 | Journal Article | Research Paper
    ​ ​Steinem, Claudia, Hans-Joachim Galla, and Andreas Janshoff. "Interaction of melittin with solid supported membranes​." ​Physical Chemistry Chemical Physics ​2, no. 20 (2000): ​4580​-4585​. ​https://doi.org/10.1039/b003865m.
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  • 2001 | Conference Paper
    ​ ​Charvat, A., J. Assmann, Bernd Abel, Dirk Schwarzer, K. Henning, Klaus Luther, and Juergen Troe. "Direct observation of intramolecular vibrational energy redistribution of selectively excited CH2I2 and C3H5I molecules in solution​." ​Physical Chemistry Chemical Physics ​3​, ​no. 12 (2001): ​2230​-2240. https://doi.org/10.1039/b100057h.
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  • 2001 | Conference Paper
    ​ ​Dashevskaya, Elena I., Ilya Litvin, E. E. Nikitin, and Juergen Troe. "Classical diffusion model of vibrational predissociation of van der Waals complexes - Part II. Comparison with trajectory calculations and analytical approximations​." ​Physical Chemistry Chemical Physics ​3​, ​no. 12 (2001): ​2315​-2324. https://doi.org/10.1039/b009299l.
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  • 2001 | Conference Paper
    ​ ​Grigoleit, U., T. Lenzer, Klaus Luther, M. Mutzel, and A. Takahara. "Collisional energy transfer of highly vibrationally excited toluene and pyrazine: Transition probabilities and relaxation pathways from KCSI experiments and trajectory calculations​." ​Physical Chemistry Chemical Physics ​3​, ​no. 12 (2001): ​2191​-2202. https://doi.org/10.1039/b100151p.
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  • 2001 | Journal Article
    ​ ​Botschwina, Peter, and Hermann Stoll. "The hydrogen-bonded cluster anions Br-center dot center dot center dot HCCH and I-center dot center dot center dot HCCH: results of coupled cluster calculations​." ​Physical Chemistry Chemical Physics ​3, no. 11 (2001): ​1965​-1972​. ​https://doi.org/10.1039/b100549i.
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  • 2001 | Conference Paper
    ​ ​Hauschildt, J., R. Schinke, S. Schmatz, and Peter Botschwina. "Unimolecular decay of the Cl-center dot center dot center dot CH3Cl complex: Influence of symmetry breaking​." ​Physical Chemistry Chemical Physics ​3​, ​no. 12 (2001): ​2275​-2281. https://doi.org/10.1039/b009879p.
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  • 2001 | Conference Paper
    ​ ​Taubmann, G., and S. Schmatz. "Numbers and densities of states and partition functions from an efficient approach to phase space integration​." ​Physical Chemistry Chemical Physics ​3​, ​no. 12 (2001): ​2296​-2305. https://doi.org/10.1039/b009788h.
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  • 2001 | Journal Article
    ​ ​Kunzmann, M. K., R. Signorell, M. Taraschewski, and S. Bauerecker. "The formation of N(2)O nanoparticles in a collisional cooling cell between 4 and 110 K​." ​Physical Chemistry Chemical Physics ​3, no. 17 (2001): ​3742​-3749​. ​https://doi.org/10.1039/b104048k.
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  • 2001 | Journal Article | Letter Note
    ​ ​Harding, L. B., Juergen Troe, and Vladimir G. Ushakov. "Comment on "On the high pressure rate constants for the H/Mu+O-2 addition reactions' by J. M. C. Marques and A. J. C. Varandas, Phys. Chem. Chem. Phys., 2001, 3, 505​." ​Physical Chemistry Chemical Physics ​3, no. 13 (2001): ​2630​-2631​. ​https://doi.org/10.1039/b102050l.
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  • 2001 | Journal Article
    ​ ​Borho, N., T. Haber, and Martin A. Suhm. "Chiral self-recognition in the gas phase: the case of glycidol dimers​." ​Physical Chemistry Chemical Physics ​3, no. 11 (2001): ​1945​-1948​. ​https://doi.org/10.1039/b102382a.
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  • 2001 | Conference Paper
    ​ ​Hack, W., Karlheinz Hoyermann, C. Kersten, M. Olzmann, and B. Viskolcz. "Mechanism of the 1-C4H9+O reaction and the kinetics of the intermediate 1-C4H9O radical​." ​Physical Chemistry Chemical Physics ​3​, ​no. 12 (2001): ​2365​-2371. https://doi.org/10.1039/b100149n.
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  • 2001 | Journal Article | Letter Note
    ​ ​Luther, Klaus, J. Schroeder, and Juergen Troe. "Competitive processes in vibrationally highly excited molecules - International Bunsen Discussion Meeting of the Deutsche Bunsen-Gesellschaft fur Physikalische Chemie, Gottingen, 4-7 October, 2000​." ​Physical Chemistry Chemical Physics ​3, no. 12 (2001): . ​
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  • 2002 | Journal Article
    ​ ​Borho, N., and Martin A. Suhm. "Glycidol dimer: anatomy of a molecular handshake​." ​Physical Chemistry Chemical Physics ​4, no. 12 (2002): ​2721​-2732​. ​https://doi.org/10.1039/b111123j.
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  • 2002 | Journal Article
    ​ ​Dashevskaya, Elena I., Ilya Litvin, E. E. Nikitin, I. Oref, and Juergen Troe. "Classical diffusion model of vibrational predissociation of van der Waals complexes - Part III. Comparison with quantum calculations​." ​Physical Chemistry Chemical Physics ​4, no. 14 (2002): ​3330​-3340​. ​https://doi.org/10.1039/b200568a.
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  • 2002 | Journal Article
    ​ ​Kappel, C., Klaus Luther, and Juergen Troe. "Shock wave study of the unimolecular dissociation of H2O2 in its falloff range and of its secondary reactions​." ​Physical Chemistry Chemical Physics ​4, no. 18 (2002): ​4392​-4398​. ​https://doi.org/10.1039/b204364e.
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  • 2002 | Conference Paper
    ​ ​Adams, S., and J. Swenson. "Bond valence analysis of transport pathways in RMC models of fast ion conducting glasses​." ​Physical Chemistry Chemical Physics ​4​, ​no. 14 (2002): ​3179​-3184. https://doi.org/10.1039/b111310k.
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  • 2002 | Journal Article
    ​ ​Chazallon, B., H. Itoh, M. Koza, Werner F. Kuhs, and H. Schober. "Anharmonicity and guest-host coupling in clathrate hydrates​." ​Physical Chemistry Chemical Physics ​4, no. 19 (2002): ​4809​-4816​. ​https://doi.org/10.1039/b202464k.
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  • 2002 | Conference Paper
    ​ ​Goos, E., H. Hippler, Karlheinz Hoyermann, and B. Jurges. "Laser powered homogeneous pyrolysis of ethyne, propyne, and propadiene initiated by methyl radicals: formation and degradation of hydrocarbons at 800-950 K​." ​Physical Chemistry Chemical Physics ​4​, ​no. 11 (2002): ​2011​-2018. https://doi.org/10.1039/b111643f.
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  • 2002 | Journal Article
    ​ ​Weimann, M., M. Farnik, and Martin A. Suhm. "A first glimpse at the acidic proton vibrations in HCl-water clusters via supersonic jet FTIR spectroscopy​." ​Physical Chemistry Chemical Physics ​4, no. 16 (2002): ​3933​-3937​. ​https://doi.org/10.1039/b204840j.
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  • 2003 | Journal Article
    ​ ​Dashevskaya, Elena I., E. E. Nikitin, K. Ohmori, M. Okunishi, I. Oref, and Y. Sato. "Energy dependence of the intramultiplet mixing cross section in Hg-N(2) collisions: Conical intersection mechanism, indication at tunneling and interference​." ​Physical Chemistry Chemical Physics ​5, no. 6 (2003): ​1198​-1204​. ​https://doi.org/10.1039/b211439a.
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  • 2003 | Journal Article
    ​ ​Haber, T.. "FTIR-spectroscopy of isolated and argon coated (HBr)(n <= 4) clusters in supersonic slit-jet expansions​." ​Physical Chemistry Chemical Physics ​5, no. 7 (2003): ​1365​-1369​. ​https://doi.org/10.1039/b212435a.
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  • 2003 | Journal Article
    ​ ​Margules, L., F. Lewen, G. Winnewisser, Peter Botschwina, and HSP Mueller. "The rotational spectrum up to 1 THz and the molecular structure of thiomethylium, HCS​." ​Physical Chemistry Chemical Physics ​5, no. 13 (2003): ​2770​-2773​. ​https://doi.org/10.1039/b303260d.
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  • 2003 | Review
    ​ ​Botschwina, Peter. "Spectroscopic properties of interstellar molecules: Theory and experiment​." Physical Chemistry Chemical Physics ​5​, no. 16​ (2003): ​3337​-3348​. ​https://doi.org/10.1039/b303753n.
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  • 2003 | Journal Article
    ​ ​Emmeluth, C., and Martin A. Suhm. "A chemical approach towards the spectroscopy of carboxylic acid dimer isomerism​." ​Physical Chemistry Chemical Physics ​5, no. 15 (2003): ​3094​-3099​. ​https://doi.org/10.1039/b303816e.
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  • 2003 | Journal Article
    ​ ​Oum, K., K. Sekiguchi, Klaus Luther, and Juergen Troe. "Observation of unique pressure effects in the combination reaction of benzyl radicals in the gas to liquid transition region​." ​Physical Chemistry Chemical Physics ​5, no. 14 (2003): ​2931​-2933​. ​https://doi.org/10.1039/b305954e.
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  • 2003 | Conference Paper
    ​ ​Oum, K., Jeremy J. Harrison, C. Lee, Duncan A. Wild, Klaus Luther, and T. Lenzer. "On-line and in situ optical detection of particles of organic molecules formed by rapid expansion of supercritical solutions (RESS) of CO2​." ​Physical Chemistry Chemical Physics ​5​, ​no. 24 (2003): ​5467​-5471. https://doi.org/10.1039/b312040f.
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  • 2003 | Journal Article
    ​ ​Bizzocchi, L., C. Degli Esposti, and Peter Botschwina. "Vibrationally excited states of HC5P: millimetre-wave spectroscopy and coupled cluster calculations​." ​Physical Chemistry Chemical Physics ​5, no. 19 (2003): ​4090​-4095​. ​https://doi.org/10.1039/b307069g.
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  • 2003 | Journal Article
    ​ ​Kling, M., and S. Schmatz. "Decarboxylation of carbonyloxy radicals: a density functional study​." ​Physical Chemistry Chemical Physics ​5, no. 18 (2003): ​3891​-3896​. ​https://doi.org/10.1039/b304544g.
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  • 2004 | Conference Paper
    ​ ​Hermsdorf, D., A. Bonnamy, Martin A. Suhm, and R. Signorell. "Infrared spectra of phenanthrene particles generated by pulsed rapid expansion of CO2 solutions​." ​Physical Chemistry Chemical Physics ​6​, ​no. 19 (2004): ​4652​-4657. https://doi.org/10.1039/b406193d.
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  • 2004 | Conference Paper
    ​ ​Liu, Y. Q., Martin A. Suhm, and Peter Botschwina. "Supersonic jet FTIR and quantum chemical investigations of ammonia/acetylene clusters​." ​Physical Chemistry Chemical Physics ​6​, ​no. 19 (2004): ​4642​-4651. https://doi.org/10.1039/b408919g.
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  • 2004 | Conference Paper
    ​ ​Botschwina, Peter, C. Hennig, and S. Schmatz. "Quantum dynamics of the complex-forming S(N)2 reaction Cl-+CD3Cl ' -> ClCD3 + Cl '(-) on a four-dimensional coupled-cluster potential surface​." ​Physical Chemistry Chemical Physics ​6​, ​no. 19 (2004): ​4630​-4635. https://doi.org/10.1039/b408965k.
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  • 2004 | Conference Paper
    ​ ​Farnik, M., C. Steinbach, M. Weimann, Udo Buck, N. Borho, and Martin A. Suhm. "Size-selective vibrational spectroscopy of methyl glycolate clusters: comparison with ragout-jet FTIR spectroscopy​." ​Physical Chemistry Chemical Physics ​6​, ​no. 19 (2004): ​4614​-4620. https://doi.org/10.1039/b408506j.
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  • 2004 | Journal Article
    ​ ​Kuhs, Werner F., G. Genov, D. K. Staykova, and Thomas C. Hansen. "Ice perfection and onset of anomalous preservation of gas hydrates​." ​Physical Chemistry Chemical Physics ​6, no. 21 (2004): ​4917​-4920​. ​https://doi.org/10.1039/b412866d.
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  • 2004 | Journal Article
    ​ ​Buback, M., M. Kling, S. Schmatz, and J. Schroeder. "Photo-induced decomposition of organic peroxides: Ultrafast formation and decarboxylation of carbonyloxy radicals​." ​Physical Chemistry Chemical Physics ​6, no. 24 (2004): ​5441​-5455​. ​https://doi.org/10.1039/b410875b.
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  • 2004 | Journal Article
    ​ ​Bizzocchi, L., C. Degli Esposti, and Peter Botschwina. "Vibrationally excited states of NC4P: millimetre-wave spectroscopy and coupled cluster calculations​." ​Physical Chemistry Chemical Physics ​6, no. 1 (2004): ​46​-50​. ​https://doi.org/10.1039/b311745f.
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  • 2004 | Journal Article
    ​ ​Luther, Klaus, K. Oum, K. Sekiguchi, and Juergen Troe. "Recombination of benzyl radicals: dependence on the bath gas, temperature, and pressure​." ​Physical Chemistry Chemical Physics ​6, no. 16 (2004): ​4133​-4141​. ​https://doi.org/10.1039/b407074g.
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  • 2004 | Journal Article
    ​ ​Häber, Thomas, Rouslan Kevorkiants, Walter Thiel, and Martin A. Suhm. "The performance of the semi-empirical AM1 method on small and nanometre-sized N2O clusters​." ​Physical Chemistry Chemical Physics ​6, no. 21 (2004): ​4939​-4949​. ​https://doi.org/10.1039/b409258a.
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  • 2004 | Journal Article
    ​ ​Hahn, J., L. Krasnoperov, Klaus Luther, and Juergen Troe. "Pressure dependence of the reaction H+O-2 (+Ar) -> HO2 (+Ar) in the range 1-900 bar and 300-700 K​." ​Physical Chemistry Chemical Physics ​6, no. 9 (2004): ​1997​-1999​. ​https://doi.org/10.1039/b404146a.
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  • 2004 | Journal Article
    ​ ​Borho, N., and Martin A. Suhm. "Tailor-made aggregates of alpha-hydroxy esters in supersonic jets​." ​Physical Chemistry Chemical Physics ​6, no. 10 (2004): ​2885​-2890​. ​https://doi.org/10.1039/b315765b.
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  • 2004 | Journal Article
    ​ ​Hoyermann, Karlheinz, Fabian Mauss, and Thomas Zeuch. "A detailed chemical reaction mechanism for the oxidation of hydrocarbons and its application to the analysis of benzene formation in fuel-rich premixed laminar acetylene and propene flames​." ​Physical Chemistry Chemical Physics ​6, no. 14 (2004): ​3824​-3835​. ​https://doi.org/10.1039/b404632c.
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  • 2004 | Journal Article
    ​ ​Liu, Y. Q., M. Weimann, and Martin A. Suhm. "Extension of panoramic cluster jet spectroscopy into the far infrared: Low frequency modes of methanol and water clusters​." ​Physical Chemistry Chemical Physics ​6, no. 13 (2004): ​3315​-3319​. ​https://doi.org/10.1039/b402379j.
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  • 2004 | Journal Article
    ​ ​Lenzer, T., and Klaus Luther. "On the accuracy of collisional energy transfer parameters for reaction kinetics applications: detailed evaluation of data from direct experiments​." ​Physical Chemistry Chemical Physics ​6, no. 5 (2004): ​955​-959​. ​https://doi.org/10.1039/b313922k.
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  • 2005 | Journal Article
    ​ ​Luther, Klaus, K. Oum, and Juergen Troe. "The role of the radical-complex mechanism in the ozone recombination/dissociation reaction​." ​Physical Chemistry Chemical Physics ​7, no. 14 (2005): ​2764​-2770​. ​https://doi.org/10.1039/b504178c.
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  • 2005 | Journal Article
    ​ ​Kopczynski, M., T. Lenzer, K. Oum, J. Seehusen, M. T. Seidel, and Vladimir G. Ushakov. "Ultrafast transient lens spectroscopy of various C-40 carotenoids: lycopene, beta-carotene, (3R,3 ' R)- zeaxanthin, (3R,3 ' R,6 ' R)-lutein, echinenone, canthaxanthin, and astaxanthin​." ​Physical Chemistry Chemical Physics ​7, no. 14 (2005): ​2793​-2803​. ​https://doi.org/10.1039/b506574g.
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  • 2005 | Journal Article
    ​ ​Frerichs, H., T. Lenzer, Klaus Luther, and Dirk Schwarzer. "Multiplex detection of collisional energy transfer using KCSFI​." ​Physical Chemistry Chemical Physics ​7, no. 4 (2005): ​620​-626​. ​https://doi.org/10.1039/b417344a.
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  • 2005 | Conference Paper
    ​ ​Troe, Juergen. "Temperature and pressure dependence of ion-molecule association and dissociation reactions: the N-2(+)+N-2(+M)double left right arrow N-4(+)(+M) reaction​." ​Physical Chemistry Chemical Physics ​7​, ​no. 7 (2005): ​1560​-1567. https://doi.org/10.1039/b417945p.
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  • 2005 | Conference Paper
    ​ ​Hennig, C., and S. Schmatz. "Reduced-dimensionality calculation of reaction cross sections and rate constant for the complex-forming gas-phase S(N)2 reaction Cl-+CH3Cl ' -> ClCH3+Cl '(-)​." ​Physical Chemistry Chemical Physics ​7​, ​no. 7 (2005): ​1552​-1559. https://doi.org/10.1039/b417288d.
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  • 2005 | Conference Paper
    ​ ​Nikitin, E. E., and Juergen Troe. "Dynamics of ion-molecule complex formation at very low energies and temperatures​." ​Physical Chemistry Chemical Physics ​7​, ​no. 7 (2005): ​1540​-1551. https://doi.org/10.1039/b416401f.
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  • 2005 | Journal Article
    ​ ​Krekeler, C., M. Mladenovic, and Peter Botschwina. "A theoretical investigation of the vibrational states of HCO2- and its isotopomers​." ​Physical Chemistry Chemical Physics ​7, no. 5 (2005): ​882​-887​. ​https://doi.org/10.1039/b417942k.
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  • 2005 | Journal Article
    ​ ​Bonnamy, A., R. Georges, E. Hugo, and R. Signorell. "IR signature of (CO2)(N) clusters: size, shape and structural effects​." ​Physical Chemistry Chemical Physics ​7, no. 5 (2005): ​963​-969​. ​https://doi.org/10.1039/b414670k.
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  • 2005 | Journal Article
    ​ ​Emmeluth, C., Volker Dyczmons, T. Kinzel, Peter Botschwina, Martin A. Suhm, and M. Yanez. "Combined jet relaxation and quantum chemical study of the pairing preferences of ethanol​." ​Physical Chemistry Chemical Physics ​7, no. 5 (2005): ​991​-997​. ​https://doi.org/10.1039/b417870j.
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  • 2005 | Conference Paper
    ​ ​Viggiano, Albert A., A. I. Fernandez, and Juergen Troe. "Ion-molecule kinetics at 15-700 Torr​." ​Physical Chemistry Chemical Physics ​7​, ​no. 7 (2005): ​1533​-1539. https://doi.org/10.1039/b417454b.
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  • 2005 | Journal Article
    ​ ​Hack, W., M. Hold, Karlheinz Hoyermann, Jens Wehmeyer, and Thomas Zeuch. "Mechanism and rate of the reaction CH3+O- revisited​." ​Physical Chemistry Chemical Physics ​7, no. 9 (2005): ​1977​-1984​. ​https://doi.org/10.1039/b419137d.
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  • 2006 | Journal Article
    ​ ​Nikitin, E. E., and J. Troe. "Restoring detailed balance in the Landau–Teller probabilities for collision-induced vibrational transitions​." ​Physical Chemistry, Chemical Physics ​8, no. 17 (2006): ​2012​-2016​. ​https://doi.org/10.1039/B517843F.
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  • 2006 | Journal Article
    ​ ​Scharge, Tina, Thomas Haeber, and Martin A. Suhm. "Quantitative chirality synchronization in trifluoroethanol dimers​." ​Physical Chemistry Chemical Physics ​8, no. 40 (2006): ​4664​-4667​. ​https://doi.org/10.1039/b609868a.
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  • 2006 | Journal Article
    ​ ​Zielke, Philipp, and Martin A. Suhm. "Concerted proton motion in hydrogen-bonded trimers: A spontaneous Raman scattering perspective​." ​Physical Chemistry Chemical Physics ​8, no. 24 (2006): ​2826​-2830​. ​https://doi.org/10.1039/b605926k.
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  • 2006 | Journal Article
    ​ ​Farnik, M., M. Weimann, C. Steinbach, Udo Buck, N. Borho, T. B. Adler, and Martin A. Suhm. "Size-selected methyl lactate clusters: fragmentation and spectroscopic fingerprints of chiral recognition​." ​Physical Chemistry Chemical Physics ​8, no. 10 (2006): ​1148​-1158​. ​https://doi.org/10.1039/b514117f.
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  • 2006 | Journal Article
    ​ ​Haramagatti, Chandrashekara Rajashekara, Akhmed Khysainovich Islamov, Holger Gibhardt, N. Gorski, Alexander Ivanovich Kuklin, and Goetz Eckold. "Pressure induced phase transitions of TTAB-micellar solutions studied by SANS and Raman spectroscopy​." ​Physical Chemistry Chemical Physics ​8, no. 8 (2006): ​994​-1000​. ​https://doi.org/10.1039/b513588e.
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  • 2006 | Journal Article
    ​ ​Wild, Duncan A., Kathrin Winkler, Sebastian Stalke, Kawon Oum, and Thomas Lenzer. "Extremely strong solvent dependence of the S-1 -> S-0 internal conversion lifetime of 12 '-apo-beta-caroten-12 '-al​." ​Physical Chemistry Chemical Physics ​8, no. 21 (2006): ​2499​-2505​. ​https://doi.org/10.1039/b601669c.
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  • 2006 | Journal Article
    ​ ​Borho, Nicole, Martin A. Suhm, Katia Le Barbu-Debus, and Anne Zehnacker. "Intra- vs. intermolecular hydrogen bonding: dimers of alpha-hydroxyesters with methanol​." ​Physical Chemistry Chemical Physics ​8, no. 38 (2006): ​4449​-4460​. ​https://doi.org/10.1039/b609725a.
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  • 2006 | Journal Article
    ​ ​Wassermann, Tobias N., David Luckhaus, Stephane Coussan, and Martin A. Suhm. "Proton tunneling estimates for malonaldehyde vibrations from supersonic jet and matrix quenching experiments​." ​Physical Chemistry Chemical Physics ​8, no. 20 (2006): ​2344​-2348​. ​https://doi.org/10.1039/b602319n.
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  • 2006 | Journal Article
    ​ ​Seurre, N., K. L. Barbu-Debus, F. Lahmani, A. Zehnacker, N. Borho, and Martin A. Suhm. "Chiral recognition between lactic acid derivatives and an aromatic alcohol in a supersonic expansion: electronic and vibrational spectroscopy​." ​Physical Chemistry Chemical Physics ​8, no. 8 (2006): ​1007​-1016​. ​https://doi.org/10.1039/b514091a.
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  • 2007 | Journal Article | Research Paper
    ​ ​Suhm, M. A.. "Spectroscopic probes of molecular recognition​." ​Physical Chemistry, Chemical Physics ​9, no. 32 (2007): ​4443​-4443​. ​https://doi.org/10.1039/b711142h.
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  • 2007 | Journal Article
    ​ ​Zielke, Philipp, and Martin A. Suhm. "Raman jet spectroscopy of formic acid dimers: low frequency vibrational dynamics and beyond​." ​Physical Chemistry Chemical Physics ​9, no. 32 (2007): ​4528​-4534​. ​https://doi.org/10.1039/b706094g.
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  • 2007 | Journal Article
    ​ ​Scharge, Tina, Christine Cézard, Philipp Zielke, Corinna Emmeluth, Martin A. Suhm, and Anne Schuetz. "A peptide co-solvent under scrutiny: self-aggregation of 2,2,2-trifluoroethanol​." ​Physical Chemistry, Chemical Physics ​9, no. 32 (2007): ​4472​-4490​. ​https://doi.org/10.1039/b705498j.
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  • 2007 | Conference Paper
    ​ ​Charvat, Ales, and Bernd Abel. "How to make big molecules fly out of liquid water: applications, features and physics of laser assisted liquid phase dispersion mass spectrometry​." ​Physical Chemistry Chemical Physics ​9​, ​no. 26 (2007): ​3335​-3360. https://doi.org/10.1039/b615114k.
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  • 2007 | Journal Article
    ​ ​Kandratsenka, Alexander, Joerg Schroeder, Dirk Schwarzer, and Vyacheslav S. Vikhrenko. "Mode-specific energy absorption by solvent molecules during CO2 vibrational cooling​." ​Physical Chemistry Chemical Physics ​9, no. 14 (2007): ​1688​-1692​. ​https://doi.org/10.1039/b618452a.
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  • 2007 | Journal Article
    ​ ​Ahmed, Syed Sayeed, Fabian Mauss, Gladys Moreac, and Thomas Zeuch. "A comprehensive and compact n-heptane oxidation model derived using chemical lumping​." ​Physical Chemistry Chemical Physics ​9, no. 9 (2007): ​1107​-1126​. ​https://doi.org/10.1039/b614712g.
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  • 2007 | Journal Article
    ​ ​Dashevskaya, Elena I., Ilya Litvin, E. E. Nikitin, and Juergen Troe. "Low temperature capture of open shell dipolar molecules by ions: the capture of rotationally selected NO((2)Pi(1/2), j) by C+​." ​Physical Chemistry Chemical Physics ​9, no. 13 (2007): ​1559​-1567​. ​https://doi.org/10.1039/b615826a.
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  • 2008 | Review
    ​ ​Nikitin, E. E., and Juergen Troe. "70 years of Landau-Teller theory for collisional energy transfer. Semiclassical three-dimensional generalizations of the classical collinear model​." Physical Chemistry Chemical Physics ​10​, no. 11​ (2008): ​1483​-1501​. ​https://doi.org/10.1039/b715095d.
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  • 2008 | Journal Article
    ​ ​Reichardt, Christian, Joerg Schroeder, and Dirk Schwarzer. "The photodecomposition mechanism of tert-butyl-9-methylfluorene-9-percarboxylate: new insight from femtosecond IR spectroscopy​." ​Physical Chemistry Chemical Physics ​10, no. 34 (2008): ​5218​-5224​. ​https://doi.org/10.1039/b806359a.
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  • 2008 | Journal Article
    ​ ​Nedic, Marija, Tobias N. Wassermann, Z. Xue, Philipp Zielke, and Martin A. Suhm. "Raman spectroscopic evidence for the most stable water/ethanol dimer and for the negative mixing energy in cold water/ethanol trimers​." ​Physical Chemistry Chemical Physics ​10, no. 39 (2008): ​5953​-5956​. ​https://doi.org/10.1039/b811154e.
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  • 2008 | Journal Article
    ​ ​Dauster, Ingo, Corey A. Rice, Philipp Zielke, and Martin A. Suhm. "N-H center dot center dot center dot pi interactions in pyrroles: systematic trends from the vibrational spectroscopy of clusters​." ​Physical Chemistry Chemical Physics ​10, no. 19 (2008): ​2827​-2835​. ​https://doi.org/10.1039/b717823a.
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  • 2008 | Journal Article
    ​ ​Fernandes, Ravi X., Klaus Luther, Juergen Troe, and Vladimir G. Ushakov. "Experimental and modelling study of the recombination reaction H+O(2)(+ M) -> HO(2)(+ M) between 300 and 900 K, 1.5 and 950 bar, and in the bath gases M = He, Ar, and N(2)​." ​Physical Chemistry Chemical Physics ​10, no. 29 (2008): ​4313​-4321​. ​https://doi.org/10.1039/b804553d.
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  • 2008 | Journal Article
    ​ ​Stalke, Sebastian, Duncan A. Wild, Thomas Lenzer, Matthaeus Kopczynski, Peter W. Lohse, and Kawon Oum. "Solvent-dependent ultrafast internal conversion dynamics of n '-apo-beta-carotenoic-n '-acids (n=8, 10, 12)​." ​Physical Chemistry Chemical Physics ​10, no. 16 (2008): ​2180​-2188​. ​https://doi.org/10.1039/b720037d.
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  • 2008 | Journal Article
    ​ ​Dauster, Ingo, Martin A. Suhm, Udo Buck, and Thomas Zeuch. "Experimental and theoretical study of the microsolvation of sodium atoms in methanol clusters: differences and similarities to sodium-water and sodium-ammonia​." ​Physical Chemistry Chemical Physics ​10, no. 1 (2008): ​83​-95​. ​https://doi.org/10.1039/b711568g.
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  • 2008 | Journal Article
    ​ ​Borba, Ana, Merwe Albrecht, Andrea Gomez-Zavaglia, Leszek Lapinski, Maciej J. Nowak, Martin A. Suhm, and Rui Fausto. "Dimer formation in nicotinamide and picolinamide in the gas and condensed phases probed by infrared spectroscopy​." ​Physical Chemistry Chemical Physics ​10, no. 46 (2008): ​7010​-7021​. ​https://doi.org/10.1039/b810002k.
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  • 2008 | Journal Article
    ​ ​Dashevskaya, Elena I., Ilya Litvin, E. E. Nikitin, and Juergen Troe. "Modelling low-energy electron-molecule capture processes​." ​Physical Chemistry Chemical Physics ​10, no. 9 (2008): ​1270​-1276​. ​https://doi.org/10.1039/b713530k.
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  • 2008 | Journal Article
    ​ ​Troe, Juergen, and Vladimir G. Ushakov. "SACM/CT Study of the dissociation/recombination dynamics of hydrogen peroxide on an ab initio potential energy surface - Part II. Specific rate constants k(E,J), thermal rate constants k(infinity)(T), and lifetime distributions​." ​Physical Chemistry Chemical Physics ​10, no. 26 (2008): ​3915​-3924​. ​https://doi.org/10.1039/b803320j.
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  • 2008 | Journal Article
    ​ ​Reichardt, Christian, Joerg Schroeder, Peter Voehringer, and Dirk Schwarzer. "Unravelling the ultrafast photodecomposition mechanism of dibenzoyl peroxide in solution by time-resolved IR spectroscopy​." ​Physical Chemistry Chemical Physics ​10, no. 12 (2008): ​1662​-1668​. ​https://doi.org/10.1039/b718501d.
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  • 2009 | Journal Article
    ​ ​Mognetti, B. M., Peter Virnau, Leonid Yelash, W. Paul, Kurt Binder, M. Mueller, and Luis Gonzalez MacDowell. "Coarse-graining dipolar interactions in simple fluids and polymer solutions: Monte Carlo studies of the phase behavior​." ​Physical Chemistry Chemical Physics ​11, no. 12 (2009): ​1923​-1933​. ​https://doi.org/10.1039/b818020m.
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  • 2009 | Journal Article
    ​ ​Brotchie, Adam, Robert Mettin, Franz Grieser, and Muthupandian Ashokkumar. "Cavitation activation by dual-frequency ultrasound and shock waves​." ​Physical Chemistry Chemical Physics ​11, no. 43 (2009): ​10029​-10034​. ​https://doi.org/10.1039/b912725a.
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  • 2009 | Journal Article
    ​ ​Hesse, Susanne, and Martin A. Suhm. "On the low volatility of cyclic esters: an infrared spectroscopy comparison between dimers of gamma-butyrolactone and methyl propionate​." ​Physical Chemistry, Chemical Physics ​11, no. 47 (2009): ​11157​-11170​. ​https://doi.org/10.1039/b915419a.
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  • 2009 | Journal Article
    ​ ​Elisbihani, K., Holger Gibhardt, and Goetz Eckold. "Switching behaviour of modulated ferroelectrics I: kinetics of the field-induced lock-in transition of Rb2ZnCl4​." ​Physical Chemistry Chemical Physics ​11, no. 17 (2009): ​3168​-3175​. ​https://doi.org/10.1039/b902368b.
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  • 2009 | Journal Article
    ​ ​Dashevskaya, Elena I., Ilya Litvin, E. E. Nikitin, and Juergen Troe. "Threshold behavior and analytical fitting of partial wave capture probabilities for attractive R-n potentials​." ​Physical Chemistry Chemical Physics ​11, no. 41 (2009): ​9364​-9369​. ​https://doi.org/10.1039/b912679a.
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  • 2009 | Journal Article
    ​ ​Dvorak, Miroslav, Vlastimil Fidler, Peter W. Lohse, Martin Michl, Kawon Oum, Philipp Wagener, and Joerg Schroeder. "Ultrafast intramolecular electronic energy transfer in rigidly linked aminopyrenyl-aminobenzanthronyl dyads-a femtosecond study​." ​Physical Chemistry Chemical Physics ​11, no. 2 (2009): ​317​-323​. ​https://doi.org/10.1039/b813232a.
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  • 2009 | Journal Article
    ​ ​Mueller, Marcus, Kostas Ch. Daoulas, and Yuki Norizoe. "Computing free energies of interfaces in self-assembling systems​." ​Physical Chemistry Chemical Physics ​11, no. 12 (2009): ​2087​-2097​. ​https://doi.org/10.1039/b818111j.
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  • 2009 | Journal Article
    ​ ​Dittrich, Birger, John E. Warren, Francesca P. A. Fabbiani, Wolfgang Morgenroth, and Ben Corry. "Temperature dependence of rotational disorder in a non-standard amino acid from X-ray crystallography and molecular dynamics simulation​." ​Physical Chemistry Chemical Physics ​11, no. 15 (2009): ​2601​-2609​. ​https://doi.org/10.1039/b819157c.
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  • 2010 | Journal Article
    ​ ​Aponte-Santamaría, Camilo, Jochen S. Hub, and Bert L. de Groot. "Dynamics and energetics of solute permeation through the Plasmodium falciparum aquaglyceroporin​." ​Physical Chemistry, Chemical Physics ​12, no. 35 (2010): ​10246​. ​https://doi.org/10.1039/c004384m.
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  • 2010 | Journal Article
    ​ ​Bennati, Marina, Claudio Luchinat, Giacomo Parigi, and Maria-Teresa Türke. "Water 1H relaxation dispersion analysis on a nitroxide radical provides information on the maximal signal enhancement in Overhauser dynamic nuclear polarization experiments​." ​Physical Chemistry, Chemical Physics ​12, no. 22 (2010): ​5902​. ​https://doi.org/10.1039/c002304n.
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  • 2010 | Journal Article
    ​ ​Larsen, Rene Wugt, and Martin A. Suhm. "The benefits of alternation and alkylation: large amplitude hydrogen bond librational modes of alcohol trimers and tetramers​." ​Physical Chemistry Chemical Physics ​12, no. 29 (2010): ​8152​-8157​. ​https://doi.org/10.1039/b925578h.
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  • 2010 | Journal Article
    ​ ​Humpolíčková, Jana, Aleš Benda, Radek Macháň, Jörg Enderlein, and Martin Hof. "Dynamic saturation optical microscopy: employing dark-state formation kinetics for resolution enhancement​." ​Physical Chemistry Chemical Physics ​12, no. 39 (2010): ​12457​-12465​. ​https://doi.org/10.1039/c0cp00059k.
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  • 2010 | Journal Article
    ​ ​Türke, Maria-Teresa, Igor Tkach, Marcel Reese, Peter Höfer, and Marina Bennati. "Optimization of dynamic nuclear polarization experiments in aqueous solution at 15 MHz/9.7 GHz: a comparative study with DNP at 140 MHz/94 GHz​." ​Physical Chemistry, Chemical Physics ​12, no. 22 (2010): ​5893​. ​https://doi.org/10.1039/c002814m.
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  • 2010 | Journal Article
    ​ ​Luettschwager, Nils O. B., Tobias N. Wassermann, Stephane Coussan, and Martin A. Suhm. "Periodic bond breaking and making in the electronic ground state on a sub-picosecond timescale: OH bending spectroscopy of malonaldehyde in the frequency domain at low temperature​." ​Physical Chemistry, Chemical Physics ​12, no. 29 (2010): ​8201​-8207​. ​https://doi.org/10.1039/c002345k.
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  • 2010 | Journal Article
    ​ ​Lenzer, Thomas, Florian Ehlers, Mirko Scholz, Rainer B. Oswald, and Kawon Oum. "Assignment of carotene S state features to the vibrationally hot ground electronic state​." ​Physical Chemistry Chemical Physics ​12, no. 31 (2010): ​8832​-8839​. ​https://doi.org/10.1039/b925071a.
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  • 2010 | Journal Article
    ​ ​Trivella, A., Tobias N. Wassermann, J. M. Mestdagh, C. Manca Tanner, F. Marinelli, Pascale Roubin, and Stephane Coussan. "New insights into the photodynamics of acetylacetone: isomerization and fragmentation in low-temperature matrixes​." ​Physical Chemistry Chemical Physics ​12, no. 29 (2010): ​8300​-8310​. ​https://doi.org/10.1039/c003593a.
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  • 2010 | Journal Article
    ​ ​Michielsen, Bart, Johan J. J. Dom, Benjamin J. van der Veken, Susanne Hesse, Z. Xue, Martin A. Suhm, and Wouter A. Herrebout. "The complexes of halothane with benzene: the temperature dependent direction of the complexation shift of the aliphatic C-H stretching​." ​Physical Chemistry, Chemical Physics ​12, no. 42 (2010): ​14034​-14044​. ​https://doi.org/10.1039/c0cp00771d.
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  • 2010 | Journal Article | Research Paper
    ​ ​Krahn, Alexander, Philip Lottmann, Thorsten Marquardsen, Andreas Tavernier, Maria-Teresa Tuerke, Marcel Reese, Andrei Leonov et al. "Shuttle DNP spectrometer with a two-center magnet​." ​Physical Chemistry Chemical Physics ​12, no. 22 (2010): ​5830​-5840​. ​https://doi.org/10.1039/c003381b.
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  • 2010 | Journal Article
    ​ ​Nikitin, E. E., and Juergen Troe. "Electron capture by finite-size polarizable molecules and clusters​." ​Physical Chemistry Chemical Physics ​12, no. 31 (2010): ​9012​-9017​. ​https://doi.org/10.1039/c001519a.
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  • 2010 | Journal Article
    ​ ​Hippler, Michael, Susanne Hesse, and Martin A. Suhm. "Quantum-chemical study and FTIR jet spectroscopy of CHCl3-NH3 association in the gas phase​." ​Physical Chemistry Chemical Physics ​12, no. 41 (2010): ​13555​-13565​. ​https://doi.org/10.1039/c0cp00530d.
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  • 2010 | Journal Article | Letter Note
    ​ ​Nesbitt, David J., and Martin A. Suhm. "Chemical dynamics of large amplitude motion​." ​Physical Chemistry Chemical Physics ​12, no. 29 (2010): . ​https://doi.org/10.1039/c0cp90051f.
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  • 2010 | Journal Article
    ​ ​Mata, Ricardo A.. "Application of high level wavefunction methods in quantum mechanics/molecular mechanics hybrid schemes​." ​Physical Chemistry, Chemical Physics ​12, no. 19 (2010): ​5041​-5052​. ​https://doi.org/10.1039/b918608e.
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  • 2010 | Journal Article
    ​ ​Hoyermann, Karlheinz, Sven Maarfeld, Frank Nacke, Joerg Nothdurft, Matthias Olzmann, Jens Wehmeyer, Oliver Welz, and Thomas Zeuch. "Rate coefficients for cycloalkyl plus O reactions and product branching in the decomposition of chemically activated cycloalkoxy radicals: an experimental and theoretical study​." ​Physical Chemistry Chemical Physics ​12, no. 31 (2010): ​8954​-8968​. ​https://doi.org/10.1039/b925920a.
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  • 2010 | Journal Article | Research Paper
    ​ ​Evers, Florian, Christian Reichhart, Roland Steitz, Metin Tolan, and Claus Czeslik. "Probing adsorption and aggregation of insulin at a poly(acrylic acid) brush​." ​Physical Chemistry, Chemical Physics ​12, no. 17 (2010): ​4375​-4382​. ​https://doi.org/10.1039/b925134k.
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  • 2011 | Journal Article
    ​ ​Türke, Maria-Teresa, and Marina Bennati. "Saturation factor of nitroxide radicals in liquid DNP by pulsed ELDOR experiments​." ​Physical Chemistry, Chemical Physics ​13, no. 9 (2011): ​3630​. ​https://doi.org/10.1039/c0cp02126a.
    ​Details  DOI 
  • 2011 | Journal Article | 
    ​ ​LaRue, Jerry, Tim Schäfer, Daniel Matsiev, Luis Velarde, Hendrik N. Nahler, Daniel J. Auerbach, and Alec M. Wodtke. "Vibrationally promoted electron emission at a metal surface: electron kinetic energy distributions​." ​Physical Chemistry Chemical Physics ​13 (2011): ​97​-99​. ​https://doi.org/10.1039/COCPO1626H.
    ​Details  DOI 
  • 2011 | Journal Article | 
    ​ ​Golibrzuch, Kai, Florian Ehlers, Mirko Scholz, Rainer B. Oswald, Thomas Lenzer, Kawon Oum, Hyungjun Kim, and Sangho Koo. "Ultrafast excited state dynamics and spectroscopy of 13,13 '-diphenyl-beta-carotene​." ​Physical Chemistry Chemical Physics ​13, no. 13 (2011): ​6340​-6351​. ​https://doi.org/10.1039/c0cp02525a.
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  • 2011 | Journal Article | 
    ​ ​Botschwina, Peter, Rainer B. Oswald, and Guntram Rauhut. "Explicitly correlated coupled cluster calculations for the propargyl cation (H2C3H+) and related species​." ​Physical Chemistry Chemical Physics ​13, no. 17 (2011): ​7921​-7929​. ​https://doi.org/10.1039/c1cp20206e.
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  • 2011 | Journal Article | 
    ​ ​Matsiev, Daniel, Zhisheng Li, Russell Cooper, Igor Rahinov, Christof Bartels, Daniel J. Auerbach, and Alec Michael Wodtke. "On the temperature dependence of electronically non-adiabatic vibrational energy transfer in molecule-surface collisions​." ​Physical Chemistry Chemical Physics ​13, no. 18 (2011): ​8153​-8162​. ​https://doi.org/10.1039/c0cp01418d.
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  • 2011 | Journal Article | 
    ​ ​Dom, Johan J. J., Benjamin J. van der Veken, Bart Michielsen, Sam Jacobs, Z. Xue, Susanne Hesse, Hans-Martin Loritz, Martin A. Suhm, and Wouter A. Herrebout. "On the weakly C-H center dot center dot center dot pi hydrogen bonded complexes of sevoflurane and benzene​." ​Physical Chemistry, Chemical Physics ​13, no. 31 (2011): ​14142​-14152​. ​https://doi.org/10.1039/c1cp20693a.
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  • 2011 | Journal Article | 
    ​ ​Mueller, Marcus, Birger Steinmueller, Kostas Ch. Daoulas, Abelardo Ramirez-Hernandez, and Juan J. de Pablo. "Polymer-solid contacts described by soft, coarse-grained models​." ​Physical Chemistry Chemical Physics ​13, no. 22 (2011): ​10491​-10502​. ​https://doi.org/10.1039/c0cp02868a.
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  • 2011 | Journal Article | 
    ​ ​Nedic, Marija, Tobias N. Wassermann, Rene Wugt Larsen, and Martin A. Suhm. "A combined Raman- and infrared jet study of mixed methanol-water and ethanol-water clusters​." ​Physical Chemistry, Chemical Physics ​13, no. 31 (2011): ​14050​-14063​. ​https://doi.org/10.1039/c1cp20182d.
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  • 2011 | Journal Article | 
    ​ ​Otto, Katharina E., Susanne Hesse, Tobias N. Wassermann, Corey A. Rice, Martin A. Suhm, Thorsten Stafforst, and Ulf Diederichsen. "Temperature-dependent intensity anomalies in amino acid esters: weak hydrogen bonds in protected glycine, alanine and valine​." ​Physical Chemistry Chemical Physics ​13, no. 31 (2011): ​14119​-14130​. ​https://doi.org/10.1039/c1cp20883g.
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  • 2011 | Journal Article | 
    ​ ​Wolf, Jan Lennard, Stefanie Richters, Josua Pecher, and Thomas Zeuch. "Pressure dependent mechanistic branching in the formation pathways of secondary organic aerosol from cyclic-alkene gas-phase ozonolysis​." ​Physical Chemistry Chemical Physics ​13, no. 23 (2011): ​10952​-10964​. ​https://doi.org/10.1039/c0cp02499f.
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  • 2011 | Journal Article | Letter Note | 
    ​ ​Suhm, Martin A., and M. Albrecht. "Comment on "Theoretical investigations into the enantiomeric and racemic forms of alpha-(trifluoromethyl)lactic acid' by R. Tonner, V. A. Soloshonok and P. Schwerdtfeger, Phys. Chem. Chem. Phys., 2011, 13, 811-817​." ​Physical Chemistry Chemical Physics ​13, no. 9 (2011): ​4159​-4160​. ​https://doi.org/10.1039/c0cp02455d.
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  • 2011 | Journal Article
    ​ ​Lohse, Peter W., Julia Kuhnt, Sergey I. Druzhinin, Mirko Scholz, Maria Ekimova, Torsten Oekermann, Thomas Lenzer, and Kawon Oum. "Ultrafast photoinduced relaxation dynamics of the indoline dye D149 in organic solvents​." ​Physical Chemistry Chemical Physics ​13, no. 43 (2011): ​19632​-19640​. ​https://doi.org/10.1039/c1cp22429h.
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  • 2011 | Journal Article | 
    ​ ​Botschwina, Peter, Rainer B. Oswald, and Otto Dopfer. "Weak interactions in ion-ligand complexes of C3H3+ isomers: competition between H-bound and C-bound structures in c-C3H3+center dot L and H2CCCH+center dot L (L = Ne, Ar, N-2, CO2, and O-2)​." ​Physical Chemistry Chemical Physics ​13, no. 31 (2011): ​14163​-14175​. ​https://doi.org/10.1039/c1cp20815b.
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  • 2011 | Journal Article | 
    ​ ​Rahinov, Igor, Russell Cooper, Daniel Matsiev, Christof Bartels, Daniel J. Auerbach, and Alec Michael Wodtke. "Quantifying the breakdown of the Born-Oppenheimer approximation in surface chemistry​." ​Physical Chemistry Chemical Physics ​13, no. 28 (2011): ​12680​-12692​. ​https://doi.org/10.1039/c1cp20356h.
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  • 2011 | Journal Article | Letter Note
    ​ ​Herrebout, Wouter A., and Martin A. Suhm. "Weak hydrogen bonds - strong effects?​." ​Physical Chemistry Chemical Physics ​13, no. 31 (2011): ​13858​-13859​. ​https://doi.org/10.1039/c1cp90110a.
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  • 2011 | Journal Article | 
    ​ ​Kollipost, Franz, Susanne Hesse, Juhyon J. Lee, and Martin A. Suhm. "Dimers of cyclic carbonates: chirality recognition in battery solvents and energy storage​." ​Physical Chemistry, Chemical Physics ​13, no. 31 (2011): ​14176​-14182​. ​https://doi.org/10.1039/c1cp21460h.
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  • 2011 | Journal Article | Research Paper
    ​ ​Möller, Johannes, Melek Cebi, Martin A. Schroer, Michael Paulus, Patrick Degen, Christoph J. Sahle, D. C. Florian Wieland et al. "Dissolution of iron oxide nanoparticles inside polymer nanocapsules​." ​Physical Chemistry, Chemical Physics ​13, no. 45 (2011): ​20354​-20360​. ​https://doi.org/10.1039/c1cp22161b.
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  • 2012 | Journal Article
    ​ ​Türke, Maria-Teresa, Giacomo Parigi, Claudio Luchinat, and Marina Bennati. "Overhauser DNP with 15 N labelled Frémy's salt at 0.35 Tesla​." ​Physical Chemistry, Chemical Physics ​14, no. 2 (2012): ​502​-510​. ​https://doi.org/10.1039/C1CP22332A.
    ​Details  DOI 
  • 2012 | Journal Article | 
    ​ ​Schaefer, Tim, Alexander Kandratsenka, Peter Voehringer, Joerg Schroeder, and Dirk Schwarzer. "Vibrational energy relaxation of the ND-stretching vibration of NH2D in liquid NH3​." ​Physical Chemistry Chemical Physics ​14, no. 33 (2012): ​11651​-11656​. ​https://doi.org/10.1039/c2cp41382e.
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  • 2012 | Journal Article
    ​ ​Forck, Richard M., Christoph C. Pradzynski, Sabine Wolff, Milan Oncak, Petr Slavicek, and Thomas Zeuch. "Size resolved infrared spectroscopy of Na(CH3OH)(n) (n=4-7) clusters in the OH stretching region: unravelling the interaction of methanol clusters with a sodium atom and the emergence of the solvated electron​." ​Physical Chemistry Chemical Physics ​14, no. 9 (2012): ​3004​-3016​. ​https://doi.org/10.1039/c2cp23301k.
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  • 2012 | Journal Article | 
    ​ ​Hennig, Carsten, and Stefan Schmatz. "Differential reaction cross sections from rotationally resolved quantum scattering calculations: application to gas-phase S(N)2 reactions​." ​Physical Chemistry Chemical Physics ​14, no. 37 (2012): ​12982​-12991​. ​https://doi.org/10.1039/c2cp41141e.
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  • 2012 | Journal Article | 
    ​ ​Lohse, Peter W., Nils Bartels, Alexander Stoppa, Richard Buchner, Thomas Lenzer, and Kawon Oum. "Dielectric relaxation and ultrafast transient absorption spectroscopy of [C(6)mim](+)[Tf2N](-)/acetonitrile mixtures​." ​Physical Chemistry Chemical Physics ​14, no. 10 (2012): ​3596​-3603​. ​https://doi.org/10.1039/c2cp23704k.
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  • 2012 | Journal Article | 
    ​ ​Fischer, Timo, Herre Jelger Risselada, and Richard L. C. Vink. "Membrane lateral structure: the influence of immobilized particles on domain size​." ​Physical Chemistry Chemical Physics ​14, no. 42 (2012): ​14500​-14508​. ​https://doi.org/10.1039/c2cp41417a.
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  • 2012 | Journal Article | 
    ​ ​Carlsson, Philip Thomas Michael, Janina Elisabeth Dege, Claudia Keunecke, Bastian Christopher Krueger, Jan Lennard Wolf, and Thomas Zeuch. "Pressure dependent aerosol formation from the cyclohexene gas-phase ozonolysis in the presence and absence of sulfur dioxide: a new perspective on the stabilisation of the initial clusters​." ​Physical Chemistry Chemical Physics ​14, no. 33 (2012): ​11695​-11705​. ​https://doi.org/10.1039/c2cp40714k.
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  • 2012 | Journal Article | 
    ​ ​Amann-Winkel, Katrin, Florian Loew, Philip H. Handle, Wiebke Knoll, Judith Peters, Burkhard Geil, Franz Fujara, and Thomas Loerting. "Limits of metastability in amorphous ices: the neutron scattering Debye-Waller factor​." ​Physical Chemistry Chemical Physics ​14, no. 47 (2012): ​16386​-16391​. ​https://doi.org/10.1039/c2cp42797d.
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  • 2012 | Journal Article | 
    ​ ​Debnarova, Andrea, Simone Techert, and Stefan Schmatz. "Limitations of high-intensity soft X-ray laser fields for the characterisation of water chemistry: Coulomb explosion of the octamer water cluster​." ​Physical Chemistry Chemical Physics ​14, no. 27 (2012): ​9606​-9614​. ​https://doi.org/10.1039/c2cp40598a.
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  • 2012 | Journal Article | 
    ​ ​Michielsen, Bart, Johan J. J. Dom, Benjamin J. van der Veken, Susanne Hesse, Martin A. Suhm, and Wouter A. Herrebout. "Solute-solvent interactions in cryosolutions: a study of halothane-ammonia complexes​." ​Physical Chemistry Chemical Physics ​14, no. 18 (2012): ​6469​-6478​. ​https://doi.org/10.1039/c2cp40379j.
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  • 2012 | Journal Article
    ​ ​Dieterich, Johannes M., Guido H. Clever, and Ricardo A. Mata. "A push-and-pull model for allosteric anion binding in cage complexes​." ​Physical Chemistry Chemical Physics ​14, no. 37 (2012): ​12746​-12749​. ​https://doi.org/10.1039/c2cp41793f.
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  • 2012 | Journal Article
    ​ ​Forck, Richard M., Johannes M. Dieterich, Christoph C. Pradzynski, Anna L. Huchting, Ricardo A. Mata, and Thomas Zeuch. "Structural diversity in sodium doped water trimers​." ​Physical Chemistry, Chemical Physics ​14, no. 25 (2012): ​9054​-9057​. ​https://doi.org/10.1039/c2cp41066d.
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  • 2012 | Journal Article
    ​ ​Hankache, Jihane, and Oliver S. Wenger. "Photoinduced electron transfer in covalent ruthenium-anthraquinone dyads: relative importance of driving-force, solvent polarity, and donor-bridge energy gap​." ​Physical Chemistry Chemical Physics ​14, no. 8 (2012): ​2685​-2692​. ​https://doi.org/10.1039/c2cp23240e.
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  • 2012 | Journal Article | 
    ​ ​Carlsson, Philip Thomas Michael, Claudia Keunecke, Bastian Christopher Krueger, Mona C. Maass, and Thomas Zeuch. "Sulfur dioxide oxidation induced mechanistic branching and particle formation during the ozonolysis of beta-pinene and 2-butene​." ​Physical Chemistry Chemical Physics ​14, no. 45 (2012): ​15637​-15640​. ​https://doi.org/10.1039/c2cp42992f.
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  • 2012 | Journal Article
    ​ ​González-Magaña, O., G. Reitsma, S. Bari, R. Hoekstra, and T. Schlathölter. "Length effects in VUV photofragmentation of protonated peptides​." ​Physical Chemistry, Chemical Physics ​14, no. 13 (2012): ​4351​-4354​. ​https://doi.org/10.1039/c2cp23470j.
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  • 2012 | Journal Article | Research Paper
    ​ ​Schroer, Martin A., Metin Tolan, and Roland Winter. "Exploring the thermodynamic derivatives of the structure factor of dense protein solutions​." ​Physical Chemistry, Chemical Physics ​14, no. 26 (2012): ​9486​-9491​. ​https://doi.org/10.1039/c2cp41041a.
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  • 2012 | Journal Article
    ​ ​Moré, René, Mirko Scholz, Gehard Busse, Lennart Busse, Carsten Paulmann, Martin Tolkiehn, and Simone Techert. "Hydrogen bond dynamics in crystalline β-9-anthracene carboxylic acid--a combined crystallographic and spectroscopic study​." ​Physical Chemistry, Chemical Physics ​14, no. 29 (2012): ​10187​-10195​. ​https://doi.org/10.1039/c2cp40216e.
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  • 2012 | Journal Article | 
    ​ ​Oum, Kawon, Peter W. Lohse, Oliver Flender, Johannes R. Klein, Mirko Scholz, Thomas Lenzer, Juan Du, and Torsten Oekermann. "Ultrafast dynamics of the indoline dye D149 on electrodeposited ZnO and sintered ZrO2 and TiO2 thin films.​." ​Physical Chemistry, Chemical Physics ​14, no. 44 (2012): ​15429​-15437​. ​https://doi.org/10.1039/c2cp42961f.
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  • 2013 | Journal Article
    ​ ​Arden-Jacob, Jutta, Karl-Heinz Drexhage, Sergey I. Druzhinin, Maria Ekimova, Oliver Flender, Thomas Lenzer, Kawon Oum, and Mirko Scholz. "Ultrafast photoinduced dynamics of the 3,6-diaminoacridinium derivative ATTO 465 in solution​." ​Physical Chemistry, Chemical Physics ​15, no. 6 (2013): ​1844​-1853​. ​https://doi.org/10.1039/C2CP43493H.
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  • 2013 | Journal Article | 
    ​ ​Graetz, Fabian, Daniel P. Engelhart, Roman J. V. Wagner, Henrik Haak, Gerard Meijer, Alec Michael Wodtke, and Tim Schaefer. "Vibrational enhancement of electron emission in CO (a(3)Pi) quenching at a clean metal surface​." ​Physical Chemistry Chemical Physics ​15, no. 36 (2013): ​14951​-14955​. ​https://doi.org/10.1039/c3cp52468j.
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  • 2013 | Journal Article | 
    ​ ​Altnoeder, Jonas, Aude Bouchet, Juhyon J. Lee, Katharina E. Otto, Martin A. Suhm, and Anne Zehnacker-Rentien. "Chirality-dependent balance between hydrogen bonding and London dispersion in isolated (+/-)-1-indanol clusters​." ​Physical Chemistry Chemical Physics ​15, no. 25 (2013): ​10167​-10180​. ​https://doi.org/10.1039/c3cp50708d.
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  • 2013 | Journal Article | 
    ​ ​Suhm, Martin A., and Franz Kollipost. "Femtisecond single-mole infrared spectroscopy of molecular clusters​." ​Physical Chemistry Chemical Physics ​15, no. 26 (2013): ​10702​-10721​. ​https://doi.org/10.1039/c3cp51515j.
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  • 2013 | Journal Article | 
    ​ ​Loew, Florian, Katrin Amann-Winkel, Thomas Loerting, Franz Fujara, and Burkhard Geil. "Ultra-slow dynamics in low density amorphous ice revealed by deuteron NMR: indication of a glass transition​." ​Physical Chemistry Chemical Physics ​15, no. 23 (2013): ​9308​-9314​. ​https://doi.org/10.1039/c3cp50818h.
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  • 2013 | Journal Article | 
    ​ ​Nelson, H., S. Schildmann, A. Nowaczyk, Catalin Gainaru, Burkhard Geil, and Roland Boehmer. "Small-angle water reorientations in KOH doped hexagonal ice and clathrate hydrates​." ​Physical Chemistry Chemical Physics ​15, no. 17 (2013): ​6355​-6367​. ​https://doi.org/10.1039/c3cp00139c.
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  • 2013 | Journal Article | 
    ​ ​Loew, Florian, Katrin Amann-Winkel, Burkhard Geil, Thomas Loerting, Carolin Wittich, and Franz Fujara. "Limits of metastability in amorphous ices: H-2-NMR relaxation​." ​Physical Chemistry Chemical Physics ​15, no. 2 (2013): ​576​-580​. ​https://doi.org/10.1039/c2cp43543h.
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  • 2013 | Journal Article | 
    ​ ​Heger, Matthias, Tina Scharge, and Martin A. Suhm. "From hydrogen bond donor to acceptor: the effect of ethanol fluorination on the first solvating water molecule​." ​Physical Chemistry Chemical Physics ​15, no. 38 (2013): ​16065​-16073​. ​https://doi.org/10.1039/c3cp53115e.
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  • 2013 | Journal Article | 
    ​ ​Sebald, Peter, Rainer B. Oswald, Peter Botschwina, and Kentarou Kawaguchi. "Rovibrational states of ClHCl- isotopologues up to high J: a joint theoretical and spectroscopic investigation​." ​Physical Chemistry Chemical Physics ​15, no. 18 (2013): ​6737​-6748​. ​https://doi.org/10.1039/c3cp44236e.
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  • 2013 | Journal Article
    ​ ​Melko, Joshua J., Shaun G. Ard, Joseph A. Fournier, Jun Li, Nicholas S. Shuman, Hua Guo, Juergen Troe, and Albert A. Viggiano. "Iron cation catalyzed reduction of N2O by CO: gas-phase temperature dependent kinetics​." ​Physical Chemistry Chemical Physics ​15, no. 27 (2013): ​11257​-11267​. ​https://doi.org/10.1039/c3cp50335f.
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  • 2013 | Journal Article | 
    ​ ​Tkach, Igor, Soraya Pornsuwan, Claudia Höbartner, Falk Wachowius, Snorri Th. Sigurdsson, Tatiana Y. Baranova, Ulf Diederichsen, Giuseppe Sicoli, and Marina Bennati. "Orientation selection in distance measurements between nitroxide spin labels at 94 GHz EPR with variable dual frequency irradiation​." ​Physical Chemistry Chemical Physics ​15, no. 10 (2013): ​3433​-3437​. ​https://doi.org/10.1039/c3cp44415e.
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  • 2013 | Journal Article
    ​ ​Andrejic, Milica, and Ricardo A. Mata. "Study of ligand effects in aurophilic interactions using local correlation methods​." ​Physical Chemistry, Chemical Physics ​15, no. 41 (2013): ​18115​-18122​. ​https://doi.org/10.1039/c3cp52931b.
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  • 2013 | Journal Article | 
    ​ ​Schaefer, Tim, Nils Bartels, Kai Golibrzuch, Christof Bartels, Hansjochen Koeckert, Daniel J. Auerbach, T. N. Kitsopoulos, and Alec Michael Wodtke. "Observation of direct vibrational excitation in gas-surface collisions of CO with Au(111): a new model system for surface dynamics​." ​Physical Chemistry Chemical Physics ​15, no. 6 (2013): ​1863​-1867​. ​https://doi.org/10.1039/c2cp43351f.
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  • 2013 | Journal Article | 
    ​ ​Hey, Jakob, Dirk Leusser, Daniel Kratzert, Heike Fliegl, Johannes M. Dieterich, Ricardo A. Mata, and Dietmar Stalke. "Heteroaromaticity approached by charge density investigations and electronic structure calculations​." ​Physical Chemistry, Chemical Physics ​15, no. 47 (2013): ​20600​-20610​. ​https://doi.org/10.1039/c3cp53756k.
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  • 2013 | Journal Article
    ​ ​Oum, Kawon, Peter W. Lohse, Johannes R. Klein, Oliver Flender, Mirko Scholz, Anders Hagfeldt, Gerrit Boschloo, and Thomas Lenzer. "Photoinduced ultrafast dynamics of the triphenylamine-based organic sensitizer D35 on TiO2, ZrO2 and in acetonitrile​." ​Physical Chemistry, Chemical Physics ​15, no. 11 (2013): ​3906​-3916​. ​https://doi.org/10.1039/c3cp44095h.
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  • 2014 | Journal Article
    ​ ​Lima, Frederico A., Thomas J. Penfold, Renske M. van der Veen, Marco Reinhard, Rafael Abela, Ivano Tavernelli, Ursula Rothlisberger, Maurizio Benfatto, Christopher J. Milne, and Majed Chergui. "Probing the electronic and geometric structure of ferric and ferrous myoglobins in physiological solutions by Fe K-edge absorption spectroscopy​." ​Physical Chemistry, Chemical Physics ​16, no. 4 (2014): ​1617​-1631​. ​https://doi.org/10.1039/C3CP53683A.
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  • 2014 | Journal Article
    ​ ​Brinkmann, Levin, Eugene Heifets, and Lev Kantorovich. "Density functional calculations of extended, periodic systems using Coulomb corrected molecular fractionation with conjugated caps method (CC-MFCC)​." ​Physical Chemistry, Chemical Physics ​16, no. 39 (2014): ​21252​-21270​. ​https://doi.org/10.1039/C3CP55119A.
    ​Details  DOI 
  • 2014 | Journal Article
    ​ ​Liu, Zhao, Weixing Li, Andreas Plog, Yeping Xu, Gerd Buntkowsky, Torsten Gutmann, and Kai Zhang. "Multi-responsive cellulose nanocrystal–rhodamine conjugates: an advanced structure study by solid-state dynamic nuclear polarization (DNP) NMR​." ​Physical Chemistry, Chemical Physics ​16, no. 47 (2014): . ​https://doi.org/10.1039/c4cp04096a.
    ​Details  DOI 
  • 2014 | Journal Article | 
    ​ ​Enkin, Nikolay, Guoquan Liu, Igor Tkach, and Marina Bennati. "High DNP efficiency of TEMPONE radicals in liquid toluene at low concentrations​." ​Physical Chemistry, Chemical Physics ​16, no. 19 (2014): ​8795​-8800​. ​https://doi.org/10.1039/C4CP00854E.
    ​Details  DOI 
  • 2014 | Journal Article
    ​ ​Nguyen Xuan Truong, Nguyen Xuan Truong, Marco Savoca, Dan J. Harding, Andre Fielicke, and Otto Dopfer. "Vibrational spectra and structures of neutral Si6X clusters (X = Be, B, C, N, O)​." ​Physical Chemistry Chemical Physics ​16, no. 40 (2014): ​22364​-22372​. ​https://doi.org/10.1039/c4cp03414g.
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  • 2014 | Journal Article
    ​ ​Cobos, C. J., Lars Soelter, Elsa Tellbach, and Juergen Troe. "Shock wave and modeling study of the thermal decomposition reactions of pentafluoroethane and 2-H-heptafluoropropane​." ​Physical Chemistry Chemical Physics ​16, no. 21 (2014): ​9797​-9807​. ​https://doi.org/10.1039/c3cp54274b.
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  • 2014 | Journal Article | 
    ​ ​Rizzato, Roberto, and Marina Bennati. "Enhanced sensitivity of electron-nuclear double resonance (ENDOR) by cross polarisation and relaxation​." ​Physical Chemistry Chemical Physics ​16, no. 17 (2014): ​7681​-7685​. ​https://doi.org/10.1039/c3cp55395g.
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  • 2014 | Journal Article | Research Paper
    ​ ​Kozuch, Jacek, Conrad Weichbrodt, Diego Millo, Karin Giller, Stefan Becker, Peter Hildebrandt, and Claudia Steinem. "Voltage-dependent structural changes of the membrane-bound anion channel hVDAC1 probed by SEIRA and electrochemical impedance spectroscopy​." ​Physical Chemistry Chemical Physics ​16, no. 20 (2014): ​9546​-9555​. ​https://doi.org/10.1039/c4cp00167b.
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  • 2014 | Journal Article | 
    ​ ​Buck, Udo, Christoph C. Pradzynski, Thomas Zeuch, Johannes M. Dieterich, and Bernd Hartke. "A size resolved investigation of large water clusters​." ​Physical Chemistry Chemical Physics ​16, no. 15 (2014): ​6859​-6871​. ​https://doi.org/10.1039/c3cp55185g.
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  • 2014 | Journal Article | 
    ​ ​Otto, Katharina E., Z. Xue, Philipp Zielke, and Martin A. Suhm. "The Raman spectrum of isolated water clusters​." ​Physical Chemistry Chemical Physics ​16, no. 21 (2014): ​9849​-9858​. ​https://doi.org/10.1039/c3cp54272f.
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  • 2014 | Journal Article | 
    ​ ​Pradzynski, Christoph C., Christoph W. Dierking, Florian Zurheide, Richard M. Forck, Udo Buck, Thomas Zeuch, and Sotiris S. Xantheas. "Infrared detection of (H2O)(20) isomers of exceptional stability: a drop-like and a face-sharing pentagonal prism cluster​." ​Physical Chemistry Chemical Physics ​16, no. 48 (2014): ​26691​-26696​. ​https://doi.org/10.1039/c4cp03642e.
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  • 2014 | Journal Article | 
    ​ ​Kollipost, Franz, Kim Papendorf, Yu-Fang Lee, Yuan-Pern Lee, and Martin A. Suhm. "Alcohol dimers - how much diagonal OH anharmonicity?​." ​Physical Chemistry Chemical Physics ​16, no. 30 (2014): ​15948​-15956​. ​https://doi.org/10.1039/c4cp01418a.
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  • 2014 | Journal Article | Research Paper
    ​ ​Voehringer-Martinez, E., O. Link, E. Lugovoy, K. R. Siefermann, F. Wiederschein, H. Grubmüller, and B. Abel. "Hydrogen bond dynamics of superheated water and methanol by ultrafast IR-pump and EUV-photoelectron probe spectroscopy​." ​Physical Chemistry Chemical Physics ​16, no. 36 (2014): ​19365​-19375​. ​https://doi.org/10.1039/c4cp02063d.
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  • 2014 | Journal Article | 
    ​ ​Golibrzuch, Kai, Pranav R. Shirhatti, Igor Rahinov, Daniel J. Auerbach, Alec Michael Wodtke, and Christof Bartels. "Incidence energy dependent state-to-state time-of-flight measurements of NO(v=3) collisions with Au(111): the fate of incidence vibrational and translational energy​." ​Physical Chemistry Chemical Physics ​16, no. 16 (2014): ​7602​-7610​. ​https://doi.org/10.1039/c3cp55224a.
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  • 2014 | Journal Article | 
    ​ ​Frank, Marina, Sebastian Funke, Hainer Wackerbarth, and Guido H. Clever. "SERS spectroscopic evidence for the integrity of surface-deposited self-assembled coordination cages​." ​Physical Chemistry Chemical Physics ​16, no. 40 (2014): ​21930​-21935​. ​https://doi.org/10.1039/c4cp02188f.
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  • 2014 | Journal Article
    ​ ​Debnarova, Andrea, Simone Techert, and Stefan Schmatz. "Contribution of Coulomb explosion to form factors and mosaicity spread in single particle X-ray scattering​." ​Physical Chemistry Chemical Physics ​16, no. 2 (2014): ​792​-798​. ​https://doi.org/10.1039/c3cp54011a.
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  • 2014 | Journal Article | Research Paper
    ​ ​Möller, Johannes, Sebastian Grobelny, Julian Schulze, Andre Steffen, Steffen Bieder, Michael Paulus, Metin Tolan, and Roland Winter. "Specific anion effects on the pressure dependence of the protein-protein interaction potential​." ​Physical Chemistry, Chemical Physics ​16, no. 16 (2014): ​7423​-7429​. ​https://doi.org/10.1039/c3cp55278k.
    ​Details  DOI  PMID  PMC 
  • 2015 | Journal Article
    ​ ​Wiederschein, F., E. Vöhringer-Martinez, A. Beinsen, F. Postberg, J. Schmidt, R. Srama, F. Stolz, H. Grubmüller, and B. Abel. "Charge separation and isolation in strong water droplet impacts​." ​Physical Chemistry Chemical Physics ​17, no. 10 (2015): ​6858​-6864​. ​https://doi.org/10.1039/C4CP05618C.
    ​Details  DOI 
  • 2015 | Journal Article | Research Paper | 
    ​ ​Heger, Matthias, Martin A. Suhm, Jonas Altnöder, and Anja Poblotzki. "To π or not to π – how does methanol dock onto anisole?​." ​Physical Chemistry, Chemical Physics ​17, no. 19 (2015): ​13045​-13052​. ​https://doi.org/10.1039/C5CP01545F.
    ​Details  DOI 
  • 2015 | Journal Article
    ​ ​Ushakov, Vladimir G., Juergen Troe, Ryan S. Johnson, Hua Guo, Shaun G. Ard, Joshua J. Melko, Nicholas S. Shuman, and Albert A. Viggiano. "Statistical modeling of the reactions Fe+ + N2O -> FeO+ + N-2 and FeO+ + CO -> Fe+ + CO2​." ​Physical Chemistry Chemical Physics ​17, no. 30 (2015): ​19700​-19708​. ​https://doi.org/10.1039/c5cp01416f.
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  • 2015 | Journal Article | 
    ​ ​Engelhart, Daniel P., Roman J. V. Wagner, Peter C. Johnsen, Alec Michael Wodtke, and Tim Schaefer. "Adsorbate enhancement of electron emission during the quenching of metastable CO at metal surfaces​." ​Physical Chemistry Chemical Physics ​17, no. 17 (2015): ​11540​-11545​. ​https://doi.org/10.1039/c5cp01255d.
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  • 2015 | Journal Article
    ​ ​Ard, Shaun G., Ryan S. Johnson, Joshua J. Melko, Oscar, Jr. Martinez, Nicholas S. Shuman, Vladimir G. Ushakov, Hua Guo, Juergen Troe, and Albert A. Viggiano. "Spin-inversion and spin-selection in the reactions FeO+ + H-2 and Fe+ + N2O​." ​Physical Chemistry Chemical Physics ​17, no. 30 (2015): ​19709​-19717​. ​https://doi.org/10.1039/c5cp01418b.
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  • 2015 | Journal Article
    ​ ​Dashevskaya, Elena I., E. E. Nikitin, and Juergen Troe. "The vibrational relaxation of NO in Ar: tunneling in a curve-crossing mechanism​." ​Physical Chemistry Chemical Physics ​17, no. 1 (2015): ​151​-158​. ​https://doi.org/10.1039/c4cp04107k.
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  • 2015 | Journal Article
    ​ ​Mahata, Manoj Kumar, Tristan Koppe, Tanusree Mondal, Christoph Bruesewitz, Kaushal Kumar, Vineet Kumar Rai, Hans Hofsaess, and Ulrich Vetter. "Incorporation of Zn2+ ions into BaTiO3:Er3+/Yb3+ nanophosphor: an effective way to enhance upconversion, defect luminescence and temperature sensing​." ​Physical Chemistry Chemical Physics ​17, no. 32 (2015): ​20741​-20753​. ​https://doi.org/10.1039/c5cp01874a.
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  • 2015 | Journal Article | 
    ​ ​Ehlers, Florian, Mirko Scholz, Jens Schimpfhauser, Juergen Bienert, Kawon Oum, and Thomas Lenzer. "Collisional relaxation of apocarotenals: identifying the S state with vibrationally excited molecules in the ground electronic state S-0​." ​Physical Chemistry Chemical Physics ​17, no. 16 (2015): ​10478​-10488​. ​https://doi.org/10.1039/c4cp05600k.
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  • 2015 | Journal Article | 
    ​ ​Idzik, Krzysztof R., Piotr J. Cywinski, Wojciech Kuznik, Jaroslaw Frydel, Tobias Licha, and Tomasz Ratajczyk. "The optical properties and quantum chemical calculations of thienyl and furyl derivatives of pyrene​." ​Physical Chemistry Chemical Physics ​17, no. 35 (2015): ​22758​-22769​. ​https://doi.org/10.1039/c5cp03013g.
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  • 2015 | Journal Article | 
    ​ ​Hennig, Carsten, and Stefan Schmatz. "Mechanisms of S(N)2 reactions: insights from a nearside/farside analysis​." ​Physical Chemistry Chemical Physics ​17, no. 40 (2015): ​26670​-26676​. ​https://doi.org/10.1039/c5cp04312c.
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  • 2015 | Journal Article | 
    ​ ​Chizhik, Anna M., Luigi Tarpani, Loredana Latterini, Ingo Gregor, Jörg Enderlein, and Alexey I. Chizhik. "Photoluminescence of a single quantum emitter in a strongly inhomogeneous chemical environment​." ​Physical Chemistry Chemical Physics ​17, no. 22 (2015): ​14994​-15000​. ​https://doi.org/10.1039/c5cp01371b.
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  • 2015 | Journal Article | 
    ​ ​Heger, Matthias, Jonas Altnoeder, Anja Poblotzki, and Martin A. Suhm. "To pi or not to pi - how does methanol dock onto anisole?​." ​Physical Chemistry Chemical Physics ​17, no. 19 (2015): ​13045​-13052​. ​https://doi.org/10.1039/c5cp01545f.
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  • 2015 | Journal Article | 
    ​ ​Nguyen Xuan Truong, Nguyen Xuan Truong, Marco Savoca, Dan J. Harding, Andre Fielicke, and Otto Dopfer. "Vibrational spectra and structures of SinC clusters (n=3-8)​." ​Physical Chemistry Chemical Physics ​17, no. 29 (2015): ​18961​-18970​. ​https://doi.org/10.1039/c5cp02588e.
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  • 2015 | Journal Article
    ​ ​Enkin, Nikolay, Guoquan Liu, Maria del Carmen Gimenez-Lopez, Kyriakos Porfyrakis, Igor Tkach, and Marina Bennati. "A high saturation factor in Overhauser DNP with nitroxide derivatives: the role of N-14 nuclear spin relaxation​." ​Physical Chemistry Chemical Physics ​17, no. 17 (2015): ​11144​-11149​. ​https://doi.org/10.1039/c5cp00935a.
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  • 2015 | Journal Article
    ​ ​Cobos, C. J., K. Hintzer, Lars Soelter, Elsa Tellbach, A. Thaler, and Juergen Troe. "Shock wave study and theoretical modeling of the thermal decomposition of c-C4F8​." ​Physical Chemistry Chemical Physics ​17, no. 48 (2015): ​32219​-32224​. ​https://doi.org/10.1039/c5cp05366h.
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  • 2015 | Journal Article | 
    ​ ​Heger, Matthias, Katharina E. Otto, Ricardo A. Mata, and Martin A. Suhm. "Bracketing subtle conformational energy differences between self-solvated and stretched trifluoropropanol.​." ​Physical Chemistry, Chemical Physics ​17, no. 15 (2015): ​9899​-9909​. ​https://doi.org/10.1039/c4cp05868b.
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  • 2015 | Journal Article | Research Paper
    ​ ​Lin, Wei, Anan Wu, Xin Lu, Xiao Tang, Daniel A. Obenchain, and Stewart E. Novick. "Internal dynamics in the molecular complex of CF3CN and H2O​." ​Physical Chemistry, Chemical Physics ​17, no. 26 (2015): ​17266​-17270​. ​https://doi.org/10.1039/c5cp01550b.
    ​Details  DOI  PMID  PMC 
  • 2016 | Journal Article
    ​ ​Han, Huixian, Benjamin Alday, Nicholas S. Shuman, Justin P. Wiens, Juergen Troe, Albert A. Viggianob, and Hua Guo. "Calculations of the active mode and energetic barrier to electron attachment to CF3 and comparison with kinetic modeling of experimental results​." ​Physical Chemistry Chemical Physics ​18, no. 45 (2016): ​31064​-31071​. ​https://doi.org/10.1039/c6cp05867a.
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  • 2016 | Journal Article | Research Paper | 
    ​ ​Lehmkühler, Felix, Yury Forov, Thomas Büning, Christoph J. Sahle, Ingo Steinke, Karin Julius, Thomas Buslaps, Metin Tolan, Mikko Hakala, and Christian Sternemann. "Intramolecular structure and energetics in supercooled water down to 255 K​." ​Physical Chemistry, Chemical Physics ​18, no. 9 (2016): ​6925​-6930​. ​https://doi.org/10.1039/C5CP07721D.
    ​Details  DOI 
  • 2016 | Journal Article | 
    ​ ​Hennig, Carsten, and Stefan Schmatz. "Reaction cross sections and thermal rate constant for Cl− + CH 3 Br → ClCH 3+ Br− from J-dependent quantum scattering calculations​." ​Physical Chemistry Chemical Physics ​18, no. 29 (2016): ​19668​-19675​. ​https://doi.org/10.1039/C6CP02799G.
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  • 2016 | Journal Article | 
    ​ ​Zhu, Qiushi, Kaibo Zheng, Mohamed Abdellah, Alexander Generalov, Dörthe Haase, Stefan Carlson, Yuran Niu, Jimmy Heimdal, Anders Engdahl, and Sophie E. Canton. "Correlating structure and electronic band-edge properties in organolead halide perovskites nanoparticles​." ​Physical Chemistry Chemical Physics ​18, no. 22 (2016): ​14933​-14940​. ​https://doi.org/10.1039/C6CP01843B.
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  • 2016 | Journal Article | Research Paper | 
    ​ ​Sahle, Christoph J., Simon Kujawski, Arndt Remhof, Yigang Yan, Nicholas P. Stadie, Ali Al-Zein, Metin Tolan, Simo Huotari, Michael Krisch, and Christian Sternemann. "In situ characterization of the decomposition behavior of Mg(BH4)2 by X-ray Raman scattering spectroscopy​." ​Physical Chemistry, Chemical Physics ​18, no. 7 (2016): ​5397​-5403​. ​https://doi.org/10.1039/C5CP06571B.
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  • 2016 | Journal Article | Research Paper
    ​ ​Schulze, Julian, Johannes Möller, Jonathan Weine, Karin Julius, Nico König, Julia Nase, Michael Paulus, Metin Tolan, and Roland Winter. "Phase behavior of lysozyme solutions in the liquid-liquid phase coexistence region at high hydrostatic pressures​." ​Physical Chemistry, Chemical Physics ​18, no. 21 (2016): ​14252​-14256​. ​https://doi.org/10.1039/c6cp01791f.
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  • 2016 | Journal Article
    ​ ​Gomez, David, and Stefan Klumpp. "Facilitated diffusion in the presence of obstacles on the DNA​." ​Physical Chemistry Chemical Physics ​18, no. 16 (2016): ​11184​-11192​. ​https://doi.org/10.1039/c6cp00307a.
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  • 2016 | Journal Article | 
    ​ ​Krueger, Bastian Christopher, Nils Bartels, Alec Michael Wodtke, and Tim Schaefer. "Final rotational state distributions from NO(v(i)=11) in collisions with Au(111): the magnitude of vibrational energy transfer depends on orientation in molecule-surface collisions​." ​Physical Chemistry Chemical Physics ​18, no. 22 (2016): ​14976​-14979​. ​https://doi.org/10.1039/c6cp02100j.
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  • 2016 | Journal Article | 
    ​ ​Poblotzki, Anja, Jonas Altnöder, and Martin A. Suhm. "Subtle solvation behaviour of a biofuel additive: the methanol complex with 2,5-dimethylfuran​." ​Physical Chemistry Chemical Physics ​18, no. 39 (2016): ​27265​-27271​. ​https://doi.org/10.1039/c6cp05413g.
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  • 2016 | Journal Article
    ​ ​Medcraft, Chris, Sabrina Zinn, Melanie Schnell, Anja Poblotzki, Jonas Altnoeder, Matthias Heger, Martin A. Suhm et al. "Aromatic embedding wins over classical hydrogen bonding - a multi-spectroscopic approach for the diphenyl ether-methanol complex​." ​Physical Chemistry Chemical Physics ​18, no. 37 (2016): ​25975​-25983​. ​https://doi.org/10.1039/c6cp03557d.
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  • 2016 | Journal Article
    ​ ​Knight, Gary, Lars Soelter, Elsa Tellbach, and Juergen Troe. "Shock wave and modeling study of the reaction CF4 (+M) double left right arrow CF3 + F (+M)​." ​Physical Chemistry Chemical Physics ​18, no. 26 (2016): ​17592​-17596​. ​https://doi.org/10.1039/c6cp03010f.
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  • 2016 | Journal Article | 
    ​ ​Park, G. Barratt, Bastian Christopher Krueger, Sven Meyer, Alec Michael Wodtke, and Tim Schaefer. "A 1+1 ' resonance-enhanced multiphoton ionization scheme for rotationally state-selective detection of formaldehyde via the (A)over-tilde (1)A(2) <- (X)over-tilde (1)A(1) transition​." ​Physical Chemistry Chemical Physics ​18, no. 32 (2016): ​22355​-22363​. ​https://doi.org/10.1039/c6cp03833f.
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  • 2016 | Journal Article | 
    ​ ​Heger, Matthias, J. M. Andersen, Martin A. Suhm, and Rene Wugt Larsen. "The donor OH stretching-libration dynamics of hydrogen-bonded methanol dimers in cryogenic matrices​." ​Physical Chemistry Chemical Physics ​18, no. 5 (2016): ​3739​-3745​. ​https://doi.org/10.1039/c5cp07387a.
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  • 2016 | Journal Article
    ​ ​Su, Shu, Yvonne Dorenkamp, Shengrui Yu, Alec Michael Wodtke, Dongxu Dai, Kaijun Yuan, and Xueming Yang. "Vacuum ultraviolet photodissociation of hydrogen bromide​." ​Physical Chemistry Chemical Physics ​18, no. 22 (2016): ​15399​-15405​. ​https://doi.org/10.1039/c6cp01956k.
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  • 2016 | Journal Article | Research Paper
    ​ ​Sahle, Christoph J., Christian Sternemann, Carlotta Giacobbe, Yigang Yan, Christopher Weis, Manuel Harder, Yury Forov et al. "Formation of CaB6 in the thermal decomposition of the hydrogen storage material Ca(BH4)2​." ​Physical Chemistry, Chemical Physics ​18, no. 29 (2016): ​19866​-19872​. ​https://doi.org/10.1039/c6cp02495e.
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  • 2017 | Journal Article
    ​ ​Hellström, Matti, and Jörg Behler. "Surface phase diagram prediction from a minimal number of DFT calculations: redox-active adsorbates on zinc oxide​." ​Physical Chemistry Chemical Physics ​19, no. 42 (2017): ​28731​-28748​. ​https://doi.org/10.1039/C7CP05182D.
    ​Details  DOI 
  • 2017 | Journal Article
    ​ ​Krüger, Bastian C., G. Barratt Park, Sven Meyer, Roman J. V. Wagner, Alec M. Wodtke, and Tim Schäfer. "Trapping-desorption and direct-scattering of formaldehyde at Au(111)​." ​Physical Chemistry Chemical Physics ​19, no. 30 (2017): ​19896​-19903​. ​https://doi.org/10.1039/C7CP03907G.
    ​Details  DOI 
  • 2017 | Journal Article
    ​ ​Tang, Qiyun, Paula C. Angelomé, Galo J. A. A. Soler-Illia, and Marcus Müller. "Formation of ordered mesostructured TiO 2 thin films: a soft coarse-grained simulation study​." ​Physical Chemistry, Chemical Physics ​19, no. 41 (2017): ​28249​-28262​. ​https://doi.org/10.1039/C7CP05304E.
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  • 2017 | Journal Article
    ​ ​Yoshitake, Mari, Yuji Kamiyama, Kengo Nishi, Nobuko Yoshimoto, Masayuki Morita, Takamasa Sakai, and Kenta Fujii. "Defect-free network formation and swelling behavior in ionic liquid-based electrolytes of tetra-arm polymers synthesized using a Michael addition reaction​." ​Physical Chemistry Chemical Physics ​19, no. 44 (2017): ​29984​-29990​. ​https://doi.org/10.1039/C7CP06126A.
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  • 2017 | Journal Article
    ​ ​Hoyermann, Karlheinz, Fabian Mauß, Matthias Olzmann, Oliver Welz, and Thomas Zeuch. "Exploring the chemical kinetics of partially oxidized intermediates by combining experiments, theory, and kinetic modeling​." ​Physical Chemistry Chemical Physics ​19, no. 28 (2017): ​18128​-18146​. ​https://doi.org/10.1039/C7CP02759A.
    ​Details  DOI 
  • 2017 | Journal Article | 
    ​ ​Liu, Guoquan, Shu-Hao Liou, Nikolay Enkin, Igor Tkach, and Marina Bennati. "Photo-induced radical polarization and liquid-state dynamic nuclear polarization using fullerene nitroxide derivatives​." ​Physical Chemistry, Chemical Physics ​19, no. 47 (2017): ​31823​-31829​. ​https://doi.org/10.1039/C7CP06073D.
    ​Details  DOI 
  • 2017 | Journal Article | 
    ​ ​Park, G. Barratt, Bastian C. Krüger, Sven Meyer, Alexander Kandratsenka, Alec M. Wodtke, and Tim Schäfer. "An axis-specific rotational rainbow in the direct scatter of formaldehyde from Au(111) and its influence on trapping probability​." ​Physical Chemistry Chemical Physics ​19, no. 30 (2017): ​19904​-19915​. ​https://doi.org/10.1039/C7CP03922K.
    ​Details  DOI 
  • 2017 | Journal Article | 
    ​ ​Bernhard, Dominic, Fabian Dietrich, Mariyam Fatima, Cristobal Perez, Anja Poblotzki, Georg Jansen, Martin A. Suhm, Melanie Schnell, and Markus Gerhards. "Multi-spectroscopic and theoretical analyses on the diphenyl ether–tert-butyl alcohol complex in the electronic ground and electronically excited state​." ​Physical Chemistry, Chemical Physics ​19, no. 27 (2017): ​18076​-18088​. ​https://doi.org/10.1039/C7CP02967E.
    ​Details  DOI 
  • 2017 | Journal Article | 
    ​ ​Forsting, Thomas, Hannes C. Gottschalk, Beppo Hartwig, Michel Mons, and Martin A. Suhm. "Correcting the record: the dimers and trimers of trans-N-methylacetamide​." ​Physical Chemistry Chemical Physics ​19, no. 17 (2017): ​10727​-10737​. ​https://doi.org/10.1039/C6CP07989J.
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  • 2017 | Journal Article
    ​ ​Cobos, C. J., K. Hintzer, Lars Soelter, Elsa Tellbach, A. Thaler, and Juergen Troe. "Shock wave studies of the pyrolysis of fluorocarbon oxygenates. II. The thermal dissociation of C4F8O​." ​Physical Chemistry Chemical Physics ​19, no. 4 (2017): ​3159​-3164​. ​https://doi.org/10.1039/c6cp06822g.
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  • 2017 | Journal Article | Research Paper
    ​ ​Ahrens, J., M. Frank, Guido H. Clever, and Dirk Schwarzer. "Ultrafast IR spectroscopy of photo-induced electron transfer in self-assembled donor-acceptor coordination cages​." ​Physical Chemistry Chemical Physics ​19, no. 21 (2017): ​13596​-13603​. ​https://doi.org/10.1039/c7cp02253k.
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  • 2017 | Journal Article
    ​ ​Vogt-Geisse, Stefan, Ricardo A. Mata, and Alejandro Toro-Labbe. "High level potential energy surface and mechanism of Al(CH3)2OCH3-promoted lactone polymerization: initiation and propagation​." ​Physical Chemistry, Chemical Physics ​19, no. 13 (2017): ​8989​-8999​. ​https://doi.org/10.1039/c7cp00809k.
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  • 2017 | Journal Article | Research Paper
    ​ ​Martin, Johannes, Melanie Graef, Thilo Kramer, Christian Jooss, Min-Ju Choe, Katsuyo Thornton, and Karl-Michael Weitzel. "Charge attachment induced transport - bulk and grain boundary diffusion of potassium in PrMnO3​." ​Physical Chemistry Chemical Physics ​19, no. 15 (2017): ​9762​-9769​. ​https://doi.org/10.1039/c7cp00198c.
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  • 2017 | Journal Article
    ​ ​Cobos, C. J., K. Hintzer, Lars Soelter, Elsa Tellbach, A. Thaler, and Juergen Troe. "Shock wave studies of the pyrolysis of fluorocarbon oxygenates. I. The thermal dissociation of C3F6O and CF3COF​." ​Physical Chemistry Chemical Physics ​19, no. 4 (2017): ​3151​-3158​. ​https://doi.org/10.1039/c6cp06816b.
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  • 2017 | Journal Article
    ​ ​Ablikim, Utuq, Cédric Bomme, Evgeny Savelyev, Hui Xiong, Razib Obaid, Balram Kaderiya, Sven Augustin et al. "Isomer-Dependent Fragmentation Dynamics of Inner-Shell Photoionized Difluoroiodobenzene​." ​Physical Chemistry, Chemical Physics ​19, no. 21 (2017): ​13419​-13431​. ​https://doi.org/10.1039/C7CP01379E.
    ​Details  DOI  arXiv 
  • 2018 | Journal Article
    ​ ​Kohse-Höinghaus, Katharina, Jürgen Troe, Jens-Uwe Grabow, Matthias Olzmann, Gernot Friedrichs, and Klaus-Dieter Hungenberg. "Kinetics in the real world: linking molecules, processes, and systems​." ​Physical Chemistry Chemical Physics ​20, no. 16 (2018): ​10561​-10568​. ​https://doi.org/10.1039/C8CP90054J.
    ​Details  DOI 
  • 2018 | Journal Article
    ​ ​Ivanović, Miloš T., Linda K. Bruetzel, Roman Shevchuk, Jan Lipfert, and Jochen S. Hub. "Quantifying the influence of the ion cloud on SAXS profiles of charged proteins​." ​Physical Chemistry Chemical Physics ​20, no. 41 (2018): ​26351​-26361​. ​https://doi.org/10.1039/C8CP03080D.
    ​Details  DOI 
  • 2018 | Journal Article
    ​ ​de Jong, Flip, Milica Feldt, Jonas Feldt, and Jeremy N. Harvey. "Modelling absorption and emission of a meso -aniline–BODIPY based dye with molecular mechanics​." ​Physical Chemistry Chemical Physics ​20, no. 21 (2018): ​14537​-14544​. ​https://doi.org/10.1039/C8CP01877D.
    ​Details  DOI 
  • 2018 | Journal Article
    ​ ​Soetbeer, Janne, Miriam Hülsmann, Adelheid Godt, Yevhen Polyhach, and Gunnar Jeschke. "Dynamical decoupling of nitroxides in o -terphenyl: a study of temperature, deuteration and concentration effects​." ​Physical Chemistry, Chemical Physics ​20, no. 3 (2018): ​1615​-1628​. ​https://doi.org/10.1039/C7CP07074H.
    ​Details  DOI 
  • 2018 | Journal Article
    ​ ​Cobos, C. J., G. Knight, L. Sölter, E. Tellbach, and J. Troe. "Experimental and modelling study of the multichannel thermal dissociations of CH 3 F and CH 2 F​." ​Physical Chemistry Chemical Physics ​20, no. 4 (2018): ​2627​-2636​. ​https://doi.org/10.1039/C7CP07098E.
    ​Details  DOI 
  • 2018 | Journal Article | Research Paper
    ​ ​Julius, Karin, Samy R. Al-Ayoubi, Michael Paulus, Metin Tolan, and Roland Winter. "The effects of osmolytes and crowding on the pressure-induced dissociation and inactivation of dimeric LADH​." ​Physical Chemistry, Chemical Physics ​20, no. 10 (2018): ​7093​-7104​. ​https://doi.org/10.1039/c7cp08242h.
    ​Details  DOI  PMID  PMC 
  • 2018 | Journal Article | Research Paper
    ​ ​Luková, Kateřina, Radim Nesvadba, Tereza Uhlíková, Daniel A. Obenchain, Dennis Wachsmuth, Jens-Uwe Grabow, and Štěpán Urban. "Ab initio conformational analysis of 1,2,3,4-tetrahydroquinoline and the high-resolution rotational spectrum of its lowest energy conformer​." ​Physical Chemistry, Chemical Physics ​20, no. 21 (2018): ​14664​-14670​. ​https://doi.org/10.1039/c8cp00953h.
    ​Details  DOI  PMID  PMC 
  • 2019 | Journal Article
    ​ ​Moosavi, R., A. Kumar, A. De Wit, and M. Schröter. "Influence of mineralization and injection flow rate on flow patterns in three-dimensional porous media​." ​Physical Chemistry Chemical Physics ​21, no. 27 (2019): ​14605​-14611​. ​https://doi.org/10.1039/C9CP01382B.
    ​Details  DOI 
  • 2019 | Journal Article | Research Paper
    ​ ​Gao, Shuang, Daniel A. Obenchain, Juncheng Lei, Gang Feng, Sven Herbers, Qian Gou, and Jens-Uwe Grabow. "Tetrel bonds and conformational equilibria in the formamide–CO2 complex: a rotational study​." ​Physical Chemistry, Chemical Physics ​21, no. 13 (2019): ​7016​-7020​. ​https://doi.org/10.1039/C9CP00055K.
    ​Details  DOI 
  • 2019 | Journal Article | 
    ​ ​Schubert, Kaja, Alexander A. Guda, Karolin Mertens, Jan O. Schunck, Stefan Schippers, Alfred Müller, Sadia Bari, Stephan Klumpp, and Michael Martins. "Absorption spectra at the iodine 3d ionisation threshold following the CHxI+ (x = 0–3) cation sequence​." ​Physical Chemistry, Chemical Physics ​21, no. 45 (2019): ​25415​-25424​. ​https://doi.org/10.1039/C9CP04640B.
    ​Details  DOI 
  • 2019 | Journal Article | 
    ​ ​Oswald, Sönke, and Martin A. Suhm. "Soft experimental constraints for soft interactions: a spectroscopic benchmark data set for weak and strong hydrogen bonds​." ​Physical Chemistry, Chemical Physics ​21, no. 35 (2019): ​18799​-18810​. ​https://doi.org/10.1039/C9CP03651B.
    ​Details  DOI 
  • 2019 | Journal Article | 
    ​ ​Oswald, Sönke, Martin A. Suhm, and Stéphane Coussan. "Incremental NH stretching downshift through stepwise nitrogen complexation of pyrrole: a combined jet expansion and matrix isolation study​." ​Physical Chemistry, Chemical Physics ​21, no. 3 (2019): ​1277​-1284​. ​https://doi.org/10.1039/C8CP07053A.
    ​Details  DOI 
  • 2019 | Journal Article | 
    ​ ​Forsting, Thomas, Julia Zischang, Martin A. Suhm, Marco Eckhoff, Benjamin Schröder, and Ricardo A. Mata. "Strained hydrogen bonding in imidazole trimer: a combined infrared, Raman, and theory study​." ​Physical Chemistry, Chemical Physics ​21, no. 11 (2019): ​5989​-5998​. ​https://doi.org/10.1039/C9CP00399A.
    ​Details  DOI 
  • 2019 | Journal Article | 
    ​ ​Bari, Sadia, Ludger Inhester, Kaja Schubert, Karolin Mertens, Jan O. Schunck, Simon Dörner, Sascha Deinert et al. "Inner-shell X-ray absorption spectra of the cationic series NHy+ (y = 0–3)​." ​Physical Chemistry, Chemical Physics ​21, no. 30 (2019): ​16505​-16514​. ​https://doi.org/10.1039/C9CP02864A.
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  • 2019 | Journal Article | 
    ​ ​Wagner, Roman J. V., Bastian C. Krüger, G. Barratt Park, Mareike Wallrabe, Alec M. Wodtke, and Tim Schäfer. "Electron transfer mediates vibrational relaxation of CO in collisions with Ag(111)​." ​Physical Chemistry Chemical Physics ​21, no. 4 (2019): ​1650​-1655​. ​https://doi.org/10.1039/C8CP06041J.
    ​Details  DOI 
  • 2019 | Journal Article | 
    ​ ​Karir, Ginny, Nils O. B. Lüttschwager, and Martin A. Suhm. "Phenylacetylene as a gas phase sliding balance for solvating alcohols​." ​Physical Chemistry, Chemical Physics ​21, no. 15 (2019): ​7831​-7840​. ​https://doi.org/10.1039/C9CP00435A.
    ​Details  DOI 
  • 2019 | Journal Article | 
    ​ ​Li, Jun, Kaisheng Song, and Jörg Behler. "A critical comparison of neural network potentials for molecular reaction dynamics with exact permutation symmetry​." ​Physical Chemistry Chemical Physics ​21, no. 19 (2019): ​9672​-9682​. ​https://doi.org/10.1039/C8CP06919K.
    ​Details  DOI 
  • 2019 | Journal Article | 
    ​ ​Bernhard, D., M. Fatima, A. Poblotzki, A. L. Steber, C. Pérez, M. A. Suhm, M. Schnell, and M. Gerhards. "Dispersion-controlled docking preference: multi-spectroscopic study on complexes of dibenzofuran with alcohols and water​." ​Physical Chemistry, Chemical Physics ​21, no. 29 (2019): ​16032​-16046​. ​https://doi.org/10.1039/C9CP02635E.
    ​Details  DOI 
  • 2019 | Journal Article | 
    ​ ​Cobos, C. J., L. Sölter, E. Tellbach, and J. Troe. "Falloff curves and mechanism of thermal decomposition of CF 3 I in shock waves​." ​Physical Chemistry Chemical Physics ​21, no. 43 (2019): ​23893​-23899​. ​https://doi.org/10.1039/C9CP04771A.
    ​Details  DOI 
  • 2019 | Journal Article | 
    ​ ​Bosse, Mathias, Jeremias Sibold, Holger A. Scheidt, Lukas J. Patalag, Katharina Kettelhoit, Annika Ries, Daniel B. Werz, Claudia Steinem, and Daniel Huster. "Shiga toxin binding alters lipid packing and the domain structure of Gb 3 -containing membranes: a solid-state NMR study​." ​Physical Chemistry, Chemical Physics ​21, no. 28 (2019): ​15630​-15638​. ​https://doi.org/10.1039/C9CP02501D.
    ​Details  DOI 
  • 2019 | Journal Article | 
    ​ ​Cobos, C. J., K. Hintzer, L. Sölter, E. Tellbach, A. Thaler, and J. Troe. "Shock wave and modelling study of the dissociation pathways of (C 2 F 5 ) 3 N​." ​Physical Chemistry Chemical Physics ​21, no. 19 (2019): ​9785​-9792​. ​https://doi.org/10.1039/C9CP01142K.
    ​Details  DOI 
  • 2019 | Journal Article
    ​ ​Paulikat, Mirko, Ricardo A. Mata, and Ricard Gelabert. "A high-throughput computational approach to UV-Vis spectra in protein mutants​." ​Physical Chemistry Chemical Physics ​21, no. 37 (2019): ​20678​-20692​. ​https://doi.org/10.1039/c9cp03908b.
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  • 2019 | Journal Article | 
    ​ ​Korchak, Sergey, Meike Emondts, Salvatore Mamone, Bernhard Blümich, and Stefan Glöggler. "Production of highly concentrated and hyperpolarized metabolites within seconds in high and low magnetic fields​." ​Physical Chemistry Chemical Physics ​21, no. 41 (2019): ​22849​-22856​. ​https://doi.org/10.1039/C9CP05227E.
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  • 2020 | Journal Article | Erratum
    ​ ​Li, Jun, Kaisheng Song, and Jörg Behler. "Correction: A critical comparison of neural network potentials for molecular reaction dynamics with exact permutation symmetry​." ​Physical Chemistry Chemical Physics ​22, no. 47 (2020): ​27914​-27915​. ​https://doi.org/10.1039/d0cp90265a.
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  • 2020 | Journal Article
    ​ ​Nejad, Arman, and Deborah L. Crittenden. "On the separability of large-amplitude motions in anharmonic frequency calculations​." ​Physical Chemistry Chemical Physics ​22, no. 36 (2020): ​20588​-20601​. ​https://doi.org/10.1039/d0cp03515g.
    ​Details  DOI 
  • 2020 | Journal Article
    ​ ​Medel, Robert, and Martin A. Suhm. "Understanding benzyl alcohol aggregation by chiral modification: the pairing step​." ​Physical Chemistry Chemical Physics ​22, no. 44 (2020): ​25538​-25551​. ​https://doi.org/10.1039/d0cp04825a.
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  • 2020 | Journal Article | Research Paper
    ​ ​Jahn, Michaela K., Daniel A. Obenchain, K. P. Rajappan Nair, Jens-Uwe Grabow, Natalja Vogt, Jean Demaison, Peter D. Godfrey, and Don McNaughton. "The puzzling hyper-fine structure and an accurate equilibrium geometry of succinic anhydride​." ​Physical Chemistry, Chemical Physics ​22, no. 9 (2020): ​5170​-5177​. ​https://doi.org/10.1039/C9CP06775B.
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  • 2020 | Journal Article
    ​ ​Sibold, Jeremias, Vera E. Tewaag, Thomas Vagedes, Ingo Mey, and Claudia Steinem. "Phase separation in pore-spanning membranes induced by differences in surface adhesion​." ​Physical Chemistry Chemical Physics ​22, no. 17 (2020): ​9308​-9315​. ​https://doi.org/10.1039/d0cp00335b.
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  • 2020 | Journal Article
    ​ ​Kastner, Alexander, Greta Koumarianou, Pavle Glodic, Peter C. Samartzis, Nicolas Ladda, Simon T. Ranecky, Tom Ring et al. "High-resolution resonance-enhanced multiphoton photoelectron circular dichroism​." ​Physical Chemistry Chemical Physics ​22, no. 14 (2020): ​7404​-7411​. ​https://doi.org/10.1039/d0cp00470g.
    ​Details  DOI 
  • 2020 | Journal Article
    ​ ​Meyer, Katharina A. E., Julia A. Davies, and Andrew M. Ellis. "Shifting formic acid dimers into perspective: vibrational scrutiny in helium nanodroplets​." ​Physical Chemistry Chemical Physics ​22, no. 17 (2020): ​9637​-9646​. ​https://doi.org/10.1039/d0cp01060j.
    ​Details  DOI 
  • 2020 | Journal Article
    ​ ​Nejad, Arman, Martin A. Suhm, and Katharina A. E. Meyer. "Increasing the weights in the molecular work-out of cis - and trans -formic acid: extension of the vibrational database via deuteration​." ​Physical Chemistry Chemical Physics ​22, no. 44 (2020): ​25492​-25501​. ​https://doi.org/10.1039/d0cp04451b.
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  • 2020 | Journal Article | Research Paper
    ​ ​Galparsoro, Oihana, Sven Kaufmann, Daniel J. Auerbach, Alexander Kandratsenka, and Alec Michael Wodtke. "First principles rates for surface chemistry employing exact transition state theory: application to recombinative desorption of hydrogen from Cu(111)​." ​Physical Chemistry Chemical Physics ​22, no. 31 (2020): ​17532​-17539​. ​https://doi.org/10.1039/d0cp02858d.
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  • 2020 | Journal Article
    ​ ​Shao, Yunqi, Matti Hellström, Are Yllö, Jonas Mindemark, Kersti Hermansson, Jörg Behler, and Chao Zhang. "Temperature effects on the ionic conductivity in concentrated alkaline electrolyte solutions​." ​Physical Chemistry Chemical Physics ​22, no. 19 (2020): ​10426​-10430​. ​https://doi.org/10.1039/c9cp06479f.
    ​Details  DOI 
  • 2020 | Journal Article | Research Paper | 
    ​ ​Wille, Sebastian, Hongyan Jiang, Oliver Bünermann, Alec Michael Wodtke, Jörg Behler, and Alexander Kandratsenka. "An experimentally validated neural-network potential energy surface for H-atom on free-standing graphene in full dimensionality​." ​Physical Chemistry Chemical Physics ​22, no. 45 (2020): ​26113​-26120​. ​https://doi.org/10.1039/d0cp03462b.
    ​Details  DOI 
  • 2020 | Journal Article | 
    ​ ​Zimmermann, C., H. C. Gottschalk, and Martin A. Suhm. "Three-dimensional docking of alcohols to ketones: an experimental benchmark based on acetophenone solvation energy balances​." ​Physical Chemistry, Chemical Physics ​22, no. 5 (2020): ​2870​-2877​. ​https://doi.org/10.1039/C9CP06128B.
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  • 2020 | Journal Article | 
    ​ ​Keller, K., I. Ritsch, H. Hintz, M. Hülsmann, M. Qi, F. D. Breitgoff, D. Klose et al. "Accessing distributions of exchange and dipolar couplings in stiff molecular rulers with Cu( ii ) centres​." ​Physical Chemistry, Chemical Physics ​22, no. 38 (2020): ​21707​-21730​. ​https://doi.org/10.1039/D0CP03105D.
    ​Details  DOI 
  • 2020 | Journal Article | 
    ​ ​Hartwig, Beppo, Manuel Lange, Anja Poblotzki, Robert Medel, Anne Zehnacker, and Martin A. Suhm. "The reduced cohesion of homoconfigurational 1,2-diols​." ​Physical Chemistry Chemical Physics ​22, no. 3 (2020): ​1122​-1136​. ​https://doi.org/10.1039/c9cp04943f.
    ​Details  DOI 
  • 2020 | Journal Article | 
    ​ ​Gawrilow, Maxim, and Martin A. Suhm. "2-Methoxyethanol: harmonic tricks, anharmonic challenges and chirality-sensitive chain aggregation​." ​Physical Chemistry, Chemical Physics ​22, no. 27 (2020): ​15303​-15311​. ​https://doi.org/10.1039/d0cp02488k.
    ​Details  DOI 
  • 2020 | Journal Article | Research Paper
    ​ ​Kraus, Peter, Daniel A. Obenchain, Sven Herbers, Dennis Wachsmuth, Irmgard Frank, and Jens-Uwe Grabow. "XeOCS: relatively straightforward?​." ​Physical Chemistry, Chemical Physics ​22, no. 10 (2020): ​5615​-5624​. ​https://doi.org/10.1039/d0cp00334d.
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  • 2021 | Journal Article
    ​ ​Wang, Hao, Xiujuan Wang, Xiao Tian, Wanying Cheng, Yang Zheng, Daniel A. Obenchain, Xuefang Xu, and Qian Gou. "Competitive tetrel bond and hydrogen bond in benzaldehyde–CO 2 : characterization via rotational spectroscopy​." ​Physical Chemistry Chemical Physics ​23, no. 45 (2021): ​25784​-25788​. ​https://doi.org/10.1039/D1CP03608D.
    ​Details  DOI 
  • 2021 | Journal Article
    ​ ​Cobos, C. J., L. Sölter, E. Tellbach, and J. Troe. "Shock wave and modelling study of the dissociation kinetics of C 2 F 5 I​." ​Physical Chemistry Chemical Physics ​23, no. 7 (2021): ​4394​-4403​. ​https://doi.org/10.1039/d0cp06414a.
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  • 2021 | Journal Article
    ​ ​Levien, Marcel, Maik Reinhard, Markus Hiller, Igor Tkach, Marina Bennati, and Tomas Orlando. "Spin density localization and accessibility of organic radicals affect liquid-state DNP efficiency​." ​Physical Chemistry Chemical Physics ​23, no. 8 (2021): ​4480​-4485​. ​https://doi.org/10.1039/d0cp05796g.
    ​Details  DOI 
  • 2021 | Journal Article
    ​ ​Jana, Pritam Kumar, Julien Lam, Rahul Mangal, Mikko J. Alava, Nagma Parveen, and Lasse Laurson. "Impurity-induced nematic–isotropic transition of liquid crystals​." ​Physical Chemistry Chemical Physics ​23, no. 14 (2021): ​8825​-8835​. ​https://doi.org/10.1039/D0CP06577C.
    ​Details  DOI 
  • 2021 | Journal Article | Research Paper | 
    ​ ​Hartwig, Beppo, and Martin A. Suhm. "Subtle hydrogen bonds: benchmarking with OH stretching fundamentals of vicinal diols in the gas phase​." ​Physical Chemistry, Chemical Physics ​23, no. 38 (2021): ​21623​-21640​. ​https://doi.org/10.1039/D1CP03367K.
    ​Details  DOI 
  • 2021 | Journal Article | 
    ​ ​Medel, Robert, and Martin A. Suhm. "Predicting OH stretching fundamental wavenumbers of alcohols for conformational assignment: different correction patterns for density functional and wave-function-based methods​." ​Physical Chemistry Chemical Physics ​23, no. 9 (2021): ​5629​-5643​. ​https://doi.org/10.1039/D1CP00342A.
    ​Details  DOI 
  • 2021 | Journal Article | 
    ​ ​Saul, Philip, Shengjun Yang, Salvatore Mamone, Felipe Opazo, Andreas Meyer, Silvio O. Rizzoli, and Stefan Glöggler. "Exotic nuclear spin behavior in dendritic macromolecules​." ​Physical Chemistry Chemical Physics ​23, no. 46 (2021): ​26349​-26355​. ​https://doi.org/10.1039/D1CP04483D.
    ​Details  DOI 
  • 2021 | Journal Article | 
    ​ ​Janek, Jürgen, Peter R. Schreiner, and Martin A. Suhm. "Understanding dispersion interactions in molecular chemistry​." ​Physical Chemistry Chemical Physics ​23, no. 15 (2021): ​8960​-8961​. ​https://doi.org/10.1039/D0CP90285C.
    ​Details  DOI 
  • 2021 | Journal Article | 
    ​ ​Meyer, Katharina A. E., and Arman Nejad. "CC-stretched formic acid: isomerisation, dimerisation, and carboxylic acid complexation​." ​Physical Chemistry Chemical Physics ​23, no. 32 (2021): ​17208​-17223​. ​https://doi.org/10.1039/D1CP02700J.
    ​Details  DOI 
  • 2021 | Journal Article | 
    ​ ​Medel, Robert. "Simple models for the quick estimation of ground state hydrogen tunneling splittings in alcohols and other compounds​." ​Physical Chemistry Chemical Physics ​23, no. 32 (2021): ​17591​-17605​. ​https://doi.org/10.1039/D1CP02115J.
    ​Details  DOI 
  • 2021 | Journal Article | 
    ​ ​Raghavan, Arjun, Louie Slocombe, Alexander Spreinat, David J. Ward, William Allison, John Ellis, Andrew P. Jardine, Marco Sacchi, and Nadav Avidor. "Alkali metal adsorption on metal surfaces: new insights from new tools​." ​Physical Chemistry Chemical Physics ​23, no. 13 (2021): ​7822​-7829​. ​https://doi.org/10.1039/D0CP05365A.
    ​Details  DOI 
  • 2021 | Journal Article | 
    ​ ​Becker, Daniel, Christoph W. Dierking, Jiří Suchan, Florian Zurheide, Jozef Lengyel, Michal Fárník, Petr Slavíček, Udo Buck, and Thomas Zeuch. "Temperature evolution in IR action spectroscopy experiments with sodium doped water clusters​." ​Physical Chemistry Chemical Physics ​23, no. 13 (2021): ​7682​-7695​. ​https://doi.org/10.1039/D0CP05390B.
    ​Details  DOI 
  • 2021 | Journal Article | 
    ​ ​Medel, Robert, Ander Camiruaga, Rizalina Tama Saragi, Pablo Pinacho, Cristóbal Pérez, Melanie Schnell, Alberto Lesarri, Martin A. Suhm, and José A. Fernández. "Rovibronic signatures of molecular aggregation in the gas phase: subtle homochirality trends in the dimer, trimer and tetramer of benzyl alcohol​." ​Physical Chemistry Chemical Physics ​23, no. 41 (2021): ​23610​-23624​. ​https://doi.org/10.1039/D1CP03508H.
    ​Details  DOI 
  • 2021 | Journal Article | Research Paper | 
    ​ ​Elbers, Mirko, Christian Schmidt, Christian Sternemann, Christoph J. Sahle, Sandro Jahn, Christian Albers, Robin Sakrowski et al. "Ion association in hydrothermal aqueous NaCl solutions: implications for the microscopic structure of supercritical water​." ​Physical Chemistry, Chemical Physics ​23, no. 27 (2021): ​14845​-14856​. ​https://doi.org/10.1039/D1CP01490K.
    ​Details  DOI 
  • 2021 | Journal Article | Research Paper | 
    ​ ​Bolle, Jennifer, S. Peter Bierwirth, Martina Požar, Aurélien Perera, Michael Paulus, Philipp Münzner, Christian Albers et al. "Isomeric effects in structure formation and dielectric dynamics of different octanols​." ​Physical Chemistry, Chemical Physics ​23, no. 42 (2021): ​24211​-24221​. ​https://doi.org/10.1039/D1CP02468J.
    ​Details  DOI 
  • 2021 | Journal Article | 
    ​ ​Cobos, C. J., L. Sölter, E. Tellbach, and J. Troe. "Shock wave and modelling study of the unimolecular dissociation of Si(CH 3 ) 2 F 2 : an access to spectroscopic and kinetic properties of SiF 2​." ​Physical Chemistry Chemical Physics ​23, no. 39 (2021): ​22437​-22442​. ​https://doi.org/10.1039/D1CP03298D.
    ​Details  DOI 
  • 2021 | Journal Article
    ​ ​Aniban, Xaiza, Beppo Hartwig, Axel Wuttke, and Ricardo A. Mata. "Dispersion forces in chirality recognition – a density functional and wave function theory study of diols​." ​Physical Chemistry Chemical Physics ​23, no. 21 (2021): ​12093​-12104​. ​https://doi.org/10.1039/D1CP01225H.
    ​Details  DOI 
  • 2022 | Journal Article
    ​ ​Wu, Bowei, Nathan A. Seifert, Aran Insausti, Jiarui Ma, Sönke Oswald, Wolfgang Jäger, and Yunjie Xu. "2,2,3,3,3-Pentafluoro-1-propanol and its dimer: structural diversity, conformational conversion, and tunnelling motion​." ​Physical Chemistry Chemical Physics ​24, no. 24 (2022): ​14975​-14984​. ​https://doi.org/10.1039/D2CP01895K.
    ​Details  DOI 
  • 2022 | Journal Article
    ​ ​Singh, Himanshi, Pablo Pinacho, Daniel A. Obenchain, María Mar Quesada-Moreno, and Melanie Schnell. "The many forms of alpha-methoxy phenylacetic acid in the gas phase: flexibility, internal dynamics, and their intramolecular interactions​." ​Physical Chemistry Chemical Physics ​24, no. 44 (2022): ​27312​-27320​. ​https://doi.org/10.1039/D2CP03962A.
    ​Details  DOI 
  • 2022 | Journal Article
    ​ ​Klose, Daniel, Sahithya Phani Babu Vemulapalli, Michal Richman, Safra Rudnick, Vered Aisha, Meital Abayev, Marina Chemerovski et al. "Cu 2+ -Induced self-assembly and amyloid formation of a cyclic d , l -α-peptide: structure and function​." ​Physical Chemistry Chemical Physics ​24, no. 11 (2022): ​6699​-6715​. ​https://doi.org/10.1039/D1CP05415E.
    ​Details  DOI 
  • 2022 | Journal Article
    ​ ​An, Qi, William L. Johnson, Konrad Samwer, Sydney L. Corona, Yidi Shen, and William A. Goddard. "The L–G phase transition in binary Cu–Zr metallic liquids​." ​Physical Chemistry Chemical Physics ​24, no. 1 (2022): ​497​-506​. ​https://doi.org/10.1039/D1CP04157F.
    ​Details  DOI 
  • 2022 | Journal Article
    ​ ​Zhang, Yaolong, Connor L. Box, Tim Schäfer, Alexander Kandratsenka, Alec Michael Wodtke, Reinhard J. Maurer, and Bin Jiang. "Stereodynamics of adiabatic and non-adiabatic energy transfer in a molecule surface encounter​." ​Physical Chemistry Chemical Physics ​24, no. 33 (2022): ​19753​-19760​. ​https://doi.org/10.1039/D2CP03312G.
    ​Details  DOI 
  • 2022 | Journal Article | 
    ​ ​Schweer, Sophie M., Arman Nejad, and Martin A. Suhm. "Coupled proton vibrations between two weak acids: the hinge complex between formic acid and trifluoroethanol​." ​Physical Chemistry Chemical Physics ​24, no. 43 (2022): ​26449​-26457​. ​https://doi.org/10.1039/D2CP04176F.
    ​Details  DOI 
  • 2022 | Journal Article | 
    ​ ​Pantoja, Christian F., Markus Zweckstetter, and Nasrollah Rezaei-Ghaleh. "Dynamical component exchange in a model phase separating system: an NMR-based approach​." ​Physical Chemistry Chemical Physics ​24, no. 10 (2022): ​6169​-6175​. ​https://doi.org/10.1039/D2CP00042C.
    ​Details  DOI 
  • 2022 | Journal Article | 
    ​ ​Ranecky, Simon T., G. Barratt Park, Peter C. Samartzis, Ioannis C. Giannakidis, Dirk Schwarzer, Arne Senftleben, Thomas Baumert, and Tim Schäfer. "Detecting chirality in mixtures using nanosecond photoelectron circular dichroism​." ​Physical Chemistry Chemical Physics ​24, no. 5 (2022): ​2758​-2761​. ​https://doi.org/10.1039/D1CP05468F.
    ​Details  DOI 
  • 2022 | Journal Article | 
    ​ ​Quesada-Moreno, María Mar, Melanie Schnell, and Daniel A. Obenchain. "Rotational analysis of naphthol-aromatic ring complexes stabilized by electrostatic and dispersion interactions​." ​Physical Chemistry Chemical Physics (2022): . ​https://doi.org/10.1039/D1CP04337D.
    ​Details  DOI 
  • 2022 | Journal Article | 
    ​ ​Ligorio, Raphael F., Jose L. Rodrigues, Anatoly Zuev, Leonardo H. R. Dos Santos, and Anna Krawczuk. "Benchmark of a functional-group database for distributed polarizability and dipole moment in biomolecules​." ​Physical Chemistry Chemical Physics ​24, no. 48 (2022): ​29495​-29504​. ​https://doi.org/10.1039/D2CP04052B.
    ​Details  DOI 
  • 2022 | Journal Article | 
    ​ ​Quesada-Moreno, María Mar, Mariyam Fatima, Robert Medel, Cristóbal Pérez, and Melanie Schnell. "Sniffing out camphor: the fine balance between hydrogen bonding and London dispersion in the chirality recognition with α-fenchol​." ​Physical Chemistry Chemical Physics (2022): . ​https://doi.org/10.1039/D2CP00308B.
    ​Details  DOI 
  • 2022 | Journal Article | 
    ​ ​Fischer, Taija L., Margarethe Bödecker, Anne Zehnacker-Rentien, Ricardo A. Mata, and Martin A. Suhm. "Setting up the HyDRA blind challenge for the microhydration of organic molecules​." ​Physical Chemistry, Chemical Physics ​24, no. 19 (2022): ​11442​-11454​. ​https://doi.org/10.1039/D2CP01119K.
    ​Details  DOI 
  • 2022 | Journal Article | 
    ​ ​Becker, Daniel, Jonas Heitland, Philip T. M. Carlsson, Jonas Elm, Tinja Olenius, Sophia Tödter, Amir Kharrazizadeh, and Thomas Zeuch. "Real-time monitoring of aerosol particle formation from sulfuric acid vapor at elevated concentrations and temperatures​." ​Physical Chemistry Chemical Physics ​24, no. 8 (2022): ​5001​-5013​. ​https://doi.org/10.1039/D1CP04580F.
    ​Details  DOI 
  • 2022 | Journal Article | 
    ​ ​Shanavas Rasheeda, Dilshana, Alberto Martín Santa Daría, Benjamin Schröder, Edit Mátyus, and Jörg Behler. "High-dimensional neural network potentials for accurate vibrational frequencies: the formic acid dimer benchmark​." ​Physical Chemistry Chemical Physics ​24, no. 48 (2022): ​29381​-29392​. ​https://doi.org/10.1039/D2CP03893E.
    ​Details  DOI 
  • 2022 | Journal Article | Research Paper | 
    ​ ​Hertl, Nils, Alexander Kandratsenka, and Alec M. Wodtke. "Effective medium theory for bcc metals: electronically non-adiabatic H atom scattering in full dimensions​." ​Physical Chemistry Chemical Physics ​24, no. 15 (2022): ​8738​-8748​. ​https://doi.org/10.1039/D2CP00087C.
    ​Details  DOI 
  • 2022 | Journal Article | 
    ​ ​Sheng, Xiaowei, Kwong Tin Tang, and J. Peter Toennies. "A semiempirical potential for alkali halide diatoms with damped interactions I. Rittner potential​." ​Physical Chemistry Chemical Physics ​24, no. 40 (2022): ​24823​-24833​. ​https://doi.org/10.1039/D2CP03405K.
    ​Details  DOI 
  • 2022 | Journal Article | 
    ​ ​Dorst, Arved C., Friedrich Güthoff, Daniel Schauermann, Alec Michael Wodtke, Daniel R. Killelea, and Tim Schäfer. "Velocity map images of desorbing oxygen from sub-surface states of Rh(111)​." ​Physical Chemistry Chemical Physics (2022): . ​https://doi.org/10.1039/D2CP03369K.
    ​Details  DOI 
  • 2022 | Journal Article | 
    ​ ​Bernasconi, Marco, Ricardo Díez Muiño, Pedro Miguel Echenique, Joseph R. Manson, Salvador Miret-Artés, and J. Peter Toennies. "New trends and challenges in surface phenomena, carbon nanostructures and helium droplets – Festschrift for Giorgio Benedek​." ​Physical Chemistry Chemical Physics (2022): . ​https://doi.org/10.1039/D2CP90196J.
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  • 2022 | Journal Article | 
    ​ ​Bernasconi, Marco, Ricardo Díez Muiño, Pedro Miguel Echenique, Joseph R. Manson, Salvador Miret-Artés, and J. Peter Toennies. "Giorgio Benedek: an extraordinary scientist and cultured gentleman​." ​Physical Chemistry Chemical Physics (2022): . ​https://doi.org/10.1039/D2CP90197H.
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  • 2022 | Journal Article | 
    ​ ​Martin-Barrios, Raidel, Nils Hertl, Oihana Galparsoro, Alexander Kandratsenka, Alec Michael Wodtke, and Pascal Larrégaray. "H atom scattering from W(110): A benchmark for molecular dynamics with electronic friction.​." ​Physical Chemistry Chemical Physics (2022): . ​https://doi.org/10.1039/D2CP01850K.
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  • 2022 | Journal Article | 
    ​ ​Lee, Jason W. L., Denis S. Tikhonov, Felix Allum, Rebecca Boll, Pragya Chopra, Benjamin Erk, Sebastian Gruet et al. "The Kinetic Energy of PAH Dication and Trication Dissociation Determined by Recoil-Frame Covariance Map Imaging​." ​Physical Chemistry, Chemical Physics ​24, no. 38 (2022): ​23096​-23105​. ​https://doi.org/10.1039/D2CP02252D.
    ​Details  DOI 
  • 2023 | Journal Article | 
    ​ ​Fiedler, J., K. Berland, J. W. Borchert, R. W. Corkery, A. Eisfeld, D. Gelbwaser-Klimovsky, M. M. Greve et al. "Perspectives on weak interactions in complex materials at different length scales​." ​Physical Chemistry Chemical Physics ​25, no. 4 (2023): ​2671​-2705​. ​https://doi.org/10.1039/D2CP03349F.
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  • 2023 | Journal Article | 
    ​ ​Becker, Stefan, Karin Giller, Daniel Sieme, and Nasrollah Rezaei-Ghaleh. "Maturation of amyloid β fibrils alters their molecular stability​." ​Physical Chemistry Chemical Physics (2023): . ​https://doi.org/10.1039/D3CP01276J.
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  • 2023 | Journal Article | 
    ​ ​Herbold, Marius, and Jörg Behler. "Machine learning transferable atomic forces for large systems from underconverged molecular fragments​." ​Physical Chemistry Chemical Physics ​25, no. 18 (2023): ​12979​-12989​. ​https://doi.org/10.1039/D2CP05976B.
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  • 2023 | Journal Article | 
    ​ ​Rzęsikowska, Katarzyna, Justyna Kalinowska-Tłuścik, and Anna Krawczuk. "Hierarchical analysis of the target-based scoring function modification for the example of selected class A GPCRs​." ​Physical Chemistry Chemical Physics ​25, no. 4 (2023): ​3513​-3520​. ​https://doi.org/10.1039/D2CP04671G.
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  • 2023 | Journal Article | 
    ​ ​Nejad, Arman, Ariel F. Pérez Mellor, Manuel Lange, Ivan Alata, Anne Zehnacker, and Martin A. Suhm. "Subtle hydrogen bond preference and dual Franck–Condon activity – the interesting pairing of 2-naphthol with anisole​." ​Physical Chemistry Chemical Physics ​25, no. 15 (2023): ​10427​-10439​. ​https://doi.org/10.1039/D3CP00160A.
    ​Details  DOI 
  • 2023 | Journal Article | 
    ​ ​Fischer, Taija L., Martijn A. Tepaske, and Martin A. Suhm. "Hydrogen sharing between two nitroxyl radicals in the gas phase and other microsolvation effects on the infrared spectrum of a bulky hydroxylamine​." ​Physical Chemistry, Chemical Physics ​25, no. 16 (2023): ​11324​-11330​. ​https://doi.org/10.1039/D3CP01156A.
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  • 2023 | Journal Article | 
    ​ ​Zimmermann, Charlotte, Arved C. Dorst, and Martin A. Suhm. "Raising the benchmark potential of a simple alcohol-ketone intermolecular balance​." ​Physical Chemistry Chemical Physics ​25, no. 1 (2023): ​384​-391​. ​https://doi.org/10.1039/D2CP05141A.
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  • 2023 | Journal Article | 
    ​ ​Dohmen, Robin, Denis Fedosov, and Daniel A. Obenchain. "Benchmarking the quadrupolar coupling tensor for chlorine to probe weak-bonding interactions​." ​Physical Chemistry Chemical Physics ​25, no. 3 (2023): ​2420​-2429​. ​https://doi.org/10.1039/D2CP04067K.
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  • 2023 | Journal Article | 
    ​ ​Reinhard, Maik, Marcel Levien, Marina Bennati, and Tomas Orlando. "Large 31 P-NMR enhancements in liquid state dynamic nuclear polarization through radical/target molecule non-covalent interaction​." ​Physical Chemistry Chemical Physics ​25, no. 1 (2023): ​822​-828​. ​https://doi.org/10.1039/D2CP04092A.
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  • 2023 | Journal Article
    ​ ​Fischer, Taija L., Margarethe Bödecker, Sophie M. Schweer, Jennifer Dupont, Valéria Lepère, Anne Zehnacker-Rentien, Martin A. Suhm et al. "The first HyDRA challenge for computational vibrational spectroscopy​." ​Physical Chemistry, Chemical Physics ​25, no. 33 (2023): ​22089​-22102​. ​https://doi.org/10.1039/D3CP01216F.
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  • 2023 | Journal Article
    ​ ​Sergeieva, Tetiana, T. Ilgin Demirer, Axel Wuttke, Ricardo A. Mata, André Schäfer, Gerrit-Jan Linker, and Diego M. Andrada. "Revisiting the origin of the bending in group 2 metallocenes AeCp 2 (Ae = Be–Ba)​." ​Physical Chemistry, Chemical Physics ​25, no. 30 (2023): ​20657​-20667​. ​https://doi.org/10.1039/D2CP05020J.
    ​Details  DOI 
  • 2023 | Journal Article
    ​ ​Mata, Ricardo A., Anne Zehnacker-Rentien, and Martin A. Suhm. "Benchmark experiments for numerical quantum chemistry​." ​Physical Chemistry Chemical Physics (2023): . ​https://doi.org/10.1039/D3CP90186F.
    ​Details  DOI 
  • 2023 | Journal Article
    ​ ​Asanbaeva, N. B., D. S. Novopashina, O. Yu. Rogozhnikova, V. M. Tormyshev, A. Kehl, A. A. Sukhanov, A. V. Shernyukov et al. "19 F electron nuclear double resonance (ENDOR) spectroscopy for distance measurements using trityl spin labels in DNA duplexes​." ​Physical Chemistry, Chemical Physics ​25, no. 35 (2023): ​23454​-23466​. ​https://doi.org/10.1039/D3CP02969G.
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  • 2023 | Journal Article
    ​ ​Schweer, Sophie M., Maxim Gawrilow, Arman Nejad, and Martin A. Suhm. "Formic acid–methanol complexation vs. esterification: elusive pre-reactive species identified by vibrational spectroscopy​." ​Physical Chemistry Chemical Physics ​25, no. 43 (2023): ​29982​-29992​. ​https://doi.org/10.1039/D3CP04705A.
    ​Details  DOI 
  • 2024 | Journal Article
    ​ ​Sieme, Daniel, and Nasrollah Rezaei-Ghaleh. "Water dynamics in eutectic solutions of sodium chloride and magnesium sulfate: implications for life in Europa's subsurface ocean and ice shell​." ​Physical Chemistry Chemical Physics ​26, no. 1 (2024): ​105​-115​. ​https://doi.org/10.1039/D3CP03455K.
    ​Details  DOI 
  • 2024 | Journal Article
    ​ ​Liebetrau, Martin, Yvonne Dorenkamp, Oliver Bünermann, and Jörg Behler. "Hydrogen atom scattering at the Al 2 O 3 (0001) surface: a combined experimental and theoretical study​." ​Physical Chemistry Chemical Physics ​26, no. 3 (2024): ​1696​-1708​. ​https://doi.org/10.1039/D3CP04729F.
    ​Details  DOI 
  • 2024 | Journal Article
    ​ ​Brás, Elisa M., Charlotte Zimmermann, Rui Fausto, and Martin A. Suhm. "Benchmarking the anisotropy of nitroxyl radical solvation with IR spectroscopy​." ​Physical Chemistry Chemical Physics ​26, no. 7 (2024): ​5822​-5829​. ​https://doi.org/10.1039/D3CP05668F.
    ​Details  DOI 
  • 2024 | Journal Article
    ​ ​Hartwig, Beppo, Melanie Schnell, Martin A. Suhm, and Daniel A. Obenchain. "Weak hydrogen bonding to halogens and chirality communication in propanols: Raman and microwave spectroscopy benchmark theory​." ​Physical Chemistry Chemical Physics ​26, no. 12 (2024): ​9432​-9452​. ​https://doi.org/10.1039/D3CP04911F.
    ​Details  DOI 
  • 2024 | Journal Article
    ​ ​Lüttschwager, Nils O. B.. "The strength of the OH-bend/OH-stretch Fermi resonance in small water clusters​." ​Physical Chemistry Chemical Physics ​26, no. 13 (2024): ​10120​-10135​. ​https://doi.org/10.1039/D3CP06255D.
    ​Details  DOI 
  • 2024 | Journal Article
    ​ ​Dupont, Jennifer, Beppo Hartwig, Katia Le Barbu-Debus, Valeria Lepere, Regis Guillot, Martin A. Suhm, and Anne Zehnacker. "Homochiral vs. heterochiral preference in chiral self-recognition of cyclic diols​." ​Physical Chemistry Chemical Physics (2024): . ​https://doi.org/10.1039/D4CP00351A.
    ​Details  DOI 

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