Higher-order equation-of-motion coupled-cluster methods for electron attachment.
about
One-particle many-body Green's function theory: Algebraic recursive definitions, linked-diagram theorem, irreducible-diagram theorem, and general-order algorithms.Relativistic equation-of-motion coupled-cluster method using open-shell reference wavefunction: Application to ionization potential.Different equation-of-motion coupled cluster methods with different reference functions: the formyl radical.Multireference Fock-space coupled-cluster and equation-of-motion coupled-cluster theories: the detailed interconnections.Potential energy curves via double electron-attachment calculations: dissociation of alkali metal dimers.Charge-transfer separability and size-extensivity in the equation-of-motion coupled cluster method: EOM-CCx.Equation-of-motion coupled cluster method for the description of the high spin excited states.Molecular response properties in equation of motion coupled cluster theory: A time-dependent perspective.Assessment of the extended Koopmans' theorem for the chemical reactivity: Accurate computations of chemical potentials, chemical hardnesses, and electrophilicity indices.Equation of motion coupled cluster methods for electron attachment and ionization potential in fullerenes C60 and C70.Equation-of-motion coupled cluster method for high spin double electron attachment calculations.The equation-of-motion coupled cluster method for triple electron attached states.Excited and ionized states of the ozone molecule with full triples coupled cluster methods.Intermediate Hamiltonian Fock-space multireference coupled-cluster method with full triples for calculation of excitation energies.
P2860
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P2860
Higher-order equation-of-motion coupled-cluster methods for electron attachment.
description
2007 nî lūn-bûn
@nan
2007年の論文
@ja
2007年学术文章
@wuu
2007年学术文章
@zh
2007年学术文章
@zh-cn
2007年学术文章
@zh-hans
2007年学术文章
@zh-my
2007年学术文章
@zh-sg
2007年學術文章
@yue
2007年學術文章
@zh-hant
name
Higher-order equation-of-motion coupled-cluster methods for electron attachment.
@en
Higher-order equation-of-motion coupled-cluster methods for electron attachment.
@nl
type
label
Higher-order equation-of-motion coupled-cluster methods for electron attachment.
@en
Higher-order equation-of-motion coupled-cluster methods for electron attachment.
@nl
prefLabel
Higher-order equation-of-motion coupled-cluster methods for electron attachment.
@en
Higher-order equation-of-motion coupled-cluster methods for electron attachment.
@nl
P2860
P356
P1476
Higher-order equation-of-motion coupled-cluster methods for electron attachment.
@en
P2093
Muneaki Kamiya
P2860
P304
P356
10.1063/1.2715575
P407
P577
2007-04-01T00:00:00Z