Nuclear magnetic resonance shielding tensors calculated with kinetic energy density-dependent exchange-correlation functionals

Chemical Physics Letters

Volumn 390, Issue 4-6, 2004, Pages 408-412

  Maximoff, Sergey N ^a   Scuseria, Gustavo E ^a  

^a RICE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ANISOTROPY; ARTICLE; CALCULATION; CORRELATION ANALYSIS; DENSITY; HYBRID; KINETICS; MAGNETIC FIELD; MOLECULAR DYNAMICS; MOLECULAR INTERACTION; MOLECULE; NUCLEAR MAGNETIC RESONANCE; VALIDATION PROCESS;

EID: 2442472150     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2004.04.049     Document Type: Article

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