Prof. Dr. Dietmar Stalke

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  • 2019 | Journal Article
    ​ ​Comparison of different strategies for modelling hydrogen atoms in charge density analyses​
    Köhler, C.; Lübben, J.; Krause, L.; Hoffmann, C.; Herbst-Irmer, R.   & Stalke, D. ​ (2019) 
    Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 75(3) pp. 434​-441​.​ DOI: https://doi.org/10.1107/S2052520619004517 
    ​Details  DOI 
  • 2019 | Journal Article
    ​ ​Statement issued on ‘metrics for crystallographic diffraction- and fit-data: a review of existing ones and the need for new ones’ from Julian Henn​
    Krause, L.; Niepötter, B.; Schürmann, C. J.; Stalke, D.   & Herbst-Irmer, R. ​ (2019) 
    Crystallography Reviews, 26(1) pp. 56​-57​.​ DOI: https://doi.org/10.1080/0889311X.2019.1653518 
    ​Details  DOI 
  • 2018 | Journal Article
    ​ ​Synthesis and Crystal Structure of a Copper(II) Benzoate Complex Bearing a Bis-2,2′-Tetrahydrofuryl Peroxide Moiety​
    Solera-Rojas, J. A.; Krause, L.; Montero, M. L.; Stalke, D.   & Pineda, L. W.​ (2018) 
    Journal of Chemical Crystallography, 48(4) pp. 138​-144​.​ DOI: https://doi.org/10.1007/s10870-018-0721-7 
    ​Details  DOI 
  • 2017 | Journal Article
    ​ ​Validation of experimental charge-density refinement strategies​
    Herbst-Irmer, R. ; Krause, L. & Stalke, D. ​ (2017) 
    Acta Crystallographica Section A Foundations and Advances, 73(a2) pp. C666​-C666​.​ DOI: https://doi.org/10.1107/S2053273317089070 
    ​Details  DOI 
  • 2017 | Journal Article
    ​ ​SPAnPS – the radiant polymorphs​
    Krause, L.; Pöppler, A.-C.; Brown, S. P.; Herbst-Irmer, R.   & Stalke, D. ​ (2017) 
    Acta Crystallographica Section A Foundations and Advances, 73(a2) pp. C755​-C755​.​ DOI: https://doi.org/10.1107/S2053273317088192 
    ​Details  DOI 
  • 2017 | Journal Article | 
    ​ ​Validation of experimental charge-density refinement strategies: when do we overfit?​
    Krause, L.; Niepötter, B.; Schürmann, C. J.; Stalke, D.   & Herbst-Irmer, R. ​ (2017) 
    IUCrJ, 4(4) pp. 420​-430​.​ DOI: https://doi.org/10.1107/S2052252517005103 
    ​Details  DOI 

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