Oxygen Interactions with Silica Surfaces: Coupled Cluster and Density Functional Investigation and the Development of a New ReaxFF Potential

标题
Oxygen Interactions with Silica Surfaces: Coupled Cluster and Density Functional Investigation and the Development of a New ReaxFF Potential
作者
关键词
-
出版物
Journal of Physical Chemistry C
Volume 117, Issue 1, Pages 258-269
出版商
American Chemical Society (ACS)
发表日期
2012-12-05
DOI
10.1021/jp3086649

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