Library-Based LAMMPS Implementation of High-Dimensional Neural Network Potentials

2019 | journal article. A publication with affiliation to the University of Göttingen.

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​Library-Based LAMMPS Implementation of High-Dimensional Neural Network Potentials​
Singraber, A.; Behler, J.   & Dellago, C.​ (2019) 
Journal of Chemical Theory and Computation, 15(3) pp. 1827​-1840​.​ DOI: https://doi.org/10.1021/acs.jctc.8b00770 

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Authors
Singraber, Andreas; Behler, Jörg ; Dellago, Christoph
Issue Date
2019
Journal
Journal of Chemical Theory and Computation 
ISSN
1549-9618
eISSN
1549-9626
Language
English

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