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× Ab initio
来源:International Journal of Molecular Sciences , 2004
作者:Frédéric Haitayan
关键词:Alcohols;Oxonium cations;...
使用许可:CC BY
来源:Brazilian Archives of Biology and Technology , 2015
作者:Farhoush Kiani, Hannaneh Behzadi, Fardad Koohyar
关键词:Dissociation constant;DFT;...
使用许可:CC BY-NC
来源:Journal of Chemical Sciences , 2012
作者:Shashank Shekhar;Bharat Lakhani;B Jayaram1 2 3;等
关键词:Ab initio;protein folding;...
使用许可:Unknown
4 Electrical resistivity of NaPb compound-forming liquid alloy using ab initio pseudopotentials [期刊论文]
来源:Pramana , 2005
作者:P K Ahluwalla, N S Negi, Anil Thakur1
关键词:Ab initio;resistivity;...
使用许可:Unknown
来源:Journal of the Korean Chemical Society , 2009
作者:O Hyung Kwon, Ja Hong Kim
关键词:Ps< >Thy;Ps< >Ps;...
使用许可:Unknown
来源:Bulletin of the Korean Chemical Society , 2018
作者:Jin Yong Lee, Sunwoo Kang, Baotao Kang
关键词:trans‐stilbene;...
使用许可:Unknown