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The Dalton quantum chemistry program systemTwo-photon absorption cross sections within equation-of-motion coupled-cluster formalism using resolution-of-the-identity and Cholesky decomposition representations: Theory, implementation, and benchmarks.Communication: A reduced-space algorithm for the solution of the complex linear response equations used in coupled cluster damped response theory.A complex-polarization-propagator protocol for magneto-chiral axial dichroism and birefringence dispersion.4-Component relativistic calculations of L3 ionization and excitations for the isoelectronic species UO2(2+), OUN(+) and UN2.Resonant-convergent second-order nonlinear response functions at the levels of Hartree-Fock and Kohn-Sham density functional theory.CC2 oscillator strengths within the local framework for calculating excitation energies (LoFEx).Molecular response properties from a Hermitian eigenvalue equation for a time-periodic Hamiltonian.Vibrational absorption spectra from vibrational coupled cluster damped linear response functions calculated using an asymmetric Lanczos algorithm.A perspective on nonresonant and resonant electronic response theory for time-dependent molecular properties.Time-dependent density functional theory of open quantum systems in the linear-response regime.The ab initio calculation of molecular electric, magnetic and geometric properties.Linear complex polarization propagator in a four-component Kohn-Sham framework.On the origin of the very strong two-photon activity of squaraine dyes--a standard/damped response theory study.Excited states in large molecular systems through polarizable embedding.Embedding beyond electrostatics-The role of wave function confinement.On the linear and non-linear electronic spectroscopy of chlorophylls: a computational study.
P2860
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P2860
description
2009 nî lūn-bûn
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2009年の論文
@ja
2009年学术文章
@wuu
2009年学术文章
@zh
2009年学术文章
@zh-cn
2009年学术文章
@zh-hans
2009年学术文章
@zh-my
2009年学术文章
@zh-sg
2009年學術文章
@yue
2009年學術文章
@zh-hant
name
Quasienergy formulation of damped response theory.
@en
Quasienergy formulation of damped response theory.
@nl
type
label
Quasienergy formulation of damped response theory.
@en
Quasienergy formulation of damped response theory.
@nl
prefLabel
Quasienergy formulation of damped response theory.
@en
Quasienergy formulation of damped response theory.
@nl
P2093
P2860
P356
P1476
Quasienergy formulation of damped response theory.
@en
P2093
Joanna Kauczor
Kasper Kristensen
Poul Jørgensen
Thomas Kjaergaard
P2860
P304
P356
10.1063/1.3173828
P407
P577
2009-07-01T00:00:00Z