Basis set dependence of atomic spin populations

Chemical Physics Letters

Volumn 495, Issue 1-3, 2010, Pages 146-150

  Philips, Jordan J ^a   Hudspeth, Mathew A ^a   Browne Jr , Philip M ^a   Peralta, Juan E ^a  

^a CENTRAL MICHIGAN UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC SPIN; BADER'S ATOMS; BASIS SETS; CU COMPLEXES; MINIMUM BASIS SETS; MULLIKEN POPULATIONS; NATURAL POPULATION ANALYSIS; OPEN-SHELL SYSTEMS; POPULATION ANALYSIS; SPIN POPULATION; STANDARD BASIS;

SPIN DYNAMICS;

EID: 77955550737     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2010.06.046     Document Type: Article

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