Analytical free energy gradient for the molecular Ornstein-Zernike self-consistent-field method

Condensed Matter Physics

Volumn 10, Issue 3, 2007, Pages 363-372

  Yoshida, N ^a  

^a INSTITUTE FOR MOLECULAR SCIENCE   (Japan)

Author keywords

Geometry optimization; Integral equation theory; MOZ SCF; RISM SCF

Indexed keywords

EID: 35248873838     PISSN: 1607324X     EISSN: None     Source Type: Journal    
DOI: 10.5488/CMP.10.3.363     Document Type: Article

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