about
Complex-scaled equation-of-motion coupled-cluster method with single and double substitutions for autoionizing excited states: theory, implementation, and examples.Complex absorbing potentials within EOM-CC family of methods: theory, implementation, and benchmarks.Complex basis functions revisited: implementation with applications to carbon tetrafluoride and aromatic N-containing heterocycles within the static-exchange approximation.Restricted and unrestricted non-Hermitian Hartree-Fock: Theory, practical considerations, and applications to metastable molecular anions.Characterizing metastable states beyond energies and lifetimes: Dyson orbitals and transition dipole moments.Accurate complex scaling of three dimensional numerical potentials.Non-iterative triple excitations in equation-of-motion coupled-cluster theory for electron attachment with applications to bound and temporary anions.Communication: Analytic gradients for the complex absorbing potential equation-of-motion coupled-cluster method.Adiabatic perturbation theory for atoms and molecules in the low-frequency regime.New algorithms for iterative matrix-free eigensolvers in quantum chemistry.Guaranteed resonance enclosures and exclosures for atoms and molecules.Hartree-Fock orbitals for complex-scaled configuration interaction calculation of highly excited Feshbach resonances.Spectral filters in quantum mechanics: A measurement theory perspectiveBalslev-Combes theorem within the framework of the finite-matrix approximation.Investigating tunnel and above-barrier ionization using complex-scaled coupled-cluster theory.Core-excited and shape resonances of uracil.Time-independent scattering theory for time-periodic Hamiltonians: Formulation and complex-scaling calculations of above-threshold-ionization spectra.Open-system Kohn-Sham density functional theoryHarmonic generation in ionizing systems by the complex scaled adiabatic-switch methodElectron-correlation effects in the positions and widths of two-electron autoionizing resonances
P2860
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P2860
description
wetenschappelijk artikel
@nl
наукова стаття, опублікована в грудні 1978
@uk
name
Resonance properties of complex-rotated hamiltonians
@en
Resonance properties of complex-rotated hamiltonians
@nl
type
label
Resonance properties of complex-rotated hamiltonians
@en
Resonance properties of complex-rotated hamiltonians
@nl
prefLabel
Resonance properties of complex-rotated hamiltonians
@en
Resonance properties of complex-rotated hamiltonians
@nl
P2093
P1433
P1476
Resonance properties of complex-rotated hamiltonians
@en
P2093
F. Weinhold
N. Moiseyev
P.R. Certain
P304
P356
10.1080/00268977800102631
P577
1978-12-01T00:00:00Z