Density Functional Theory

Comprehensive Coordination Chemistry II

Volumn 2, Issue , 2004, Pages 491-510

  Noodleman, L ^a   Lovell, T ^a   Han, W G ^a   Liu, T ^a   Torres, R A ^a   Himo, F ^a  

^a SCRIPPS RESEARCH INSTITUTE   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL EFFICIENCY; ELECTRONIC STRUCTURE; ELECTROSTATICS; EXCITED STATES; GROUND STATE; METAL COMPLEXES; QUANTUM THEORY; SPIN POLARIZATION; TRANSITION METALS;

BROAD APPLICATION; COMPLICATED SYSTEMS; DENSITY-FUNCTIONAL-THEORY; ELECTRON CORRELATION EFFECT; ELECTRONIC STRUCTURE CALCULATIONS; MAIN GROUP; ORGANIC GROUP; QUANTUM MECHANICAL; SPIN-POLARIZED; TRANSITION-METAL COMPLEX;

DENSITY FUNCTIONAL THEORY;

EID: 84870427684     PISSN: None     EISSN: None     Source Type: Book    
DOI: 10.1016/B0-08-043748-6/01067-7     Document Type: Chapter

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