Block diagonalization of the equation-of-motion coupled cluster effective Hamiltonian: treatment of diabatic potential constants and triple excitations.
about
Constructing diabatic representations using adiabatic and approximate diabatic data--Coping with diabolical singularities.A simple quasi-diabatization scheme suitable for spectroscopic problems based on one-electron properties of interacting states.A diabatization protocol that includes spin-orbit coupling.Development of highly accurate approximate scheme for computing the charge transfer integral.
P2860
Block diagonalization of the equation-of-motion coupled cluster effective Hamiltonian: treatment of diabatic potential constants and triple excitations.
description
2014 nî lūn-bûn
@nan
2014年の論文
@ja
2014年学术文章
@wuu
2014年学术文章
@zh-cn
2014年学术文章
@zh-hans
2014年学术文章
@zh-my
2014年学术文章
@zh-sg
2014年學術文章
@yue
2014年學術文章
@zh
2014年學術文章
@zh-hant
name
Block diagonalization of the e ...... stants and triple excitations.
@en
Block diagonalization of the e ...... stants and triple excitations.
@nl
type
label
Block diagonalization of the e ...... stants and triple excitations.
@en
Block diagonalization of the e ...... stants and triple excitations.
@nl
prefLabel
Block diagonalization of the e ...... stants and triple excitations.
@en
Block diagonalization of the e ...... stants and triple excitations.
@nl
P2860
P356
P1476
Block diagonalization of the e ...... stants and triple excitations.
@en
P2093
John F Stanton
Robert J Cave
P2860
P304
P356
10.1063/1.4880757
P407
P577
2014-06-01T00:00:00Z