Transferability in the natural linear-scaled coupled-cluster effective Hamiltonian approach: Applications to dynamic polarizabilities and dispersion coefficients

Journal of Chemical Physics

Volumn 129, Issue 5, 2008, Pages

  Hughes, Thomas F ^a   Bartlett, Rodney J ^a  

^a University of Florida ^*  (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AMINO ACIDS; CHEMICAL BONDS; CHLORINE COMPOUNDS; DISPERSION (WAVES); DYNAMIC RESPONSE; EQUATIONS OF MOTION; EXCITED STATES; FLOW INTERACTIONS; HAMILTONIANS; HYDROCARBONS; MOLECULAR ORBITALS; PARAFFINS; QUANTUM CHEMISTRY; SECURITY OF DATA;

CARBOXYL GROUPS; CC METHODS; COUPLED CLUSTERS; COUPLED-CLUSTER METHOD; DE-EXCITATIONS; DISPERSION COEFFICIENTS; DYNAMIC POLARIZABILITIES; EFFECTIVE HAMILTONIAN; FIRST EXCITED STATE; LARGE MOLECULES; LOCALIZED MOLECULAR ORBITALS; POLYGLYCINE; RESPONSE PROPERTIES;

MOLECULES;

EID: 49349087268     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2961037     Document Type: Article

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