Theoretical Predictions of Energetic Molecular Crystals at Ambient and Hydrostatic Compression Conditions Using Dispersion Corrections to Conventional Density Functionals (DFT-D)

标题
Theoretical Predictions of Energetic Molecular Crystals at Ambient and Hydrostatic Compression Conditions Using Dispersion Corrections to Conventional Density Functionals (DFT-D)
作者
关键词
-
出版物
Journal of Physical Chemistry C
Volume 114, Issue 14, Pages 6734-6748
出版商
American Chemical Society (ACS)
发表日期
2010-03-12
DOI
10.1021/jp100379a

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