Linear response functions for coupled cluster/molecular mechanics including polarization interactions

Journal of Chemical Physics

Volumn 118, Issue 4, 2003, Pages 1620-1633

  Kongsted, Jacob ^a   Osted, Anders ^a   Mikkelsen, Kurt V ^a   Christiansen, Ove ^b  

^a UNIVERSITY OF COPENHAGEN   (Denmark)

^b AARHUS UNIVERSITY   (Denmark)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRON TRANSITIONS; ELECTRONIC STRUCTURE; ELECTROSTATICS; GROUND STATE; HAMILTONIANS; LIQUIDS; MATHEMATICAL MODELS; MOLECULES; POLARIZATION; QUANTUM THEORY; VAN DER WAALS FORCES;

COUPLED CLUSTER MOLECULAR MECHANICS; COUPLED CLUSTER SINGLES AND DOUBLES; LINEAR RESPONSE FUNCTIONS; LIQUID WATER;

MOLECULAR DYNAMICS;

EID: 0037460275     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1529680     Document Type: Article

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