A transferable electrostatic model for intermolecular interactions between polycyclic aromatic hydrocarbons

Chemical Physics Letters

Volumn 510, Issue 1-3, 2011, Pages 154-160

  Totton, Tim S ^a   Misquitta, Alston J ^b   Kraft, Markus ^a  

^a UNIVERSITY OF CAMBRIDGE   (United Kingdom)

^b UNIVERSITY OF CAMBRIDGE   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO CALCULATIONS; ANISOTROPIC POTENTIAL; ATOMIC CHARGE; ELECTROSTATIC MODELS; INTERMOLECULAR INTERACTIONS; QUADRUPOLAR MOMENTS;

ANISOTROPY; AROMATIC COMPOUNDS; CALCULATIONS; HYDROCARBONS; POLYCYCLIC AROMATIC HYDROCARBONS;

ELECTROSTATICS;

EID: 79958776942     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2011.05.021     Document Type: Article

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