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Time-dependent density functional theory quantum transport simulation in non-orthogonal basis.
Kwok, Yan Ho; Xie, Hang; Yam, Chi Yung; Zheng, Xiao; Chen, Guan Hua.
Affiliation
  • Kwok YH; Department of Chemistry, The University of Hong Kong, Pokfulam Road, Hong Kong.
  • Xie H; Department of Chemistry, The University of Hong Kong, Pokfulam Road, Hong Kong.
  • Yam CY; Department of Chemistry, The University of Hong Kong, Pokfulam Road, Hong Kong.
  • Zheng X; Hefei National Laboratory for Physical Sciences at the Microscale, University of Science and Technology of China, Hefei, Anhui 230026, China.
  • Chen GH; Department of Chemistry, The University of Hong Kong, Pokfulam Road, Hong Kong.
J Chem Phys ; 139(22): 224111, 2013 Dec 14.
Article in En | MEDLINE | ID: mdl-24329060
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Full text: 1 Collection: 01-internacional Database: MEDLINE Language: En Journal: J Chem Phys Year: 2013 Type: Article Affiliation country: Hong Kong
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PubMed Links
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Full text: 1 Collection: 01-internacional Database: MEDLINE Language: En Journal: J Chem Phys Year: 2013 Type: Article Affiliation country: Hong Kong