Determination of a Density Functional Tight Binding Model with an Extended Basis Set and Three-Body Repulsion for Carbon Under Extreme Pressures and Temperatures

标题
Determination of a Density Functional Tight Binding Model with an Extended Basis Set and Three-Body Repulsion for Carbon Under Extreme Pressures and Temperatures
作者
关键词
-
出版物
Journal of Physical Chemistry C
Volume 117, Issue 15, Pages 7885-7894
出版商
American Chemical Society (ACS)
发表日期
2013-03-20
DOI
10.1021/jp312759j

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