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Nonempirical Range-Separated Hybrid Functional with Spatially Dependent Screened Exchange.
J Chem Theory Comput. 2023 Sep 12;19(17):5851-5862. doi: 10.1021/acs.jctc.3c00580. Epub 2023 Aug 17.
J Chem Theory Comput. 2023.
PMID: 37591004
Ogre: A Python package for molecular crystal surface generation with applications to surface energy and crystal habit prediction.
Yang S, Bier I, Wen W, Zhan J, Moayedpour S, Marom N.
Yang S, et al. Among authors: zhan j.
J Chem Phys. 2020 Jun 28;152(24):244122. doi: 10.1063/5.0010615.
J Chem Phys. 2020.
PMID: 32610993
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