Molecular applications of state-specific multireference perturbation theory to HF, H2O, H2S, C2, and N2 molecules.

Molecular applications of state-specific multireference perturbation theory to HF, H2O, H2S, C2, and N2 molecules.

Item
http://www.wikidata.org/entity/Q51620746
Extended multi-configuration quasi-degenerate perturbation theory: the new approach to multi-state multi-reference perturbation theory.C2 in a Box: Determining Its Intrinsic Bond Strength for the X(1)Σg(+) Ground State.A simplified ab initio treatment of diradicaloid structures produced from stretching and breaking chemical bonds.State-specific multireference perturbation theory with improved virtual orbitals: taming the ground state of F2 , Be2, and N2.Improved virtual orbitals in state specific multireference perturbation theory for prototypes of quasidegenerate electronic structure.Relativistic state-specific multireference perturbation theory incorporating improved virtual orbitals: Application to the ground state single-bond dissociation.Application of improved virtual orbital based multireference methods to N2, LiF, and C4H6 systems.A spin-adapted size-extensive state-specific multi-reference perturbation theory with various partitioning schemes. II. Molecular applications.Excited states using semistochastic heat-bath configuration interaction.A general non-Abelian density matrix renormalization group algorithm with application to the C2 dimer.An orbital-invariant internally contracted multireference coupled cluster approach.
P2860

Molecular applications of state-specific multireference perturbation theory to HF, H2O, H2S, C2, and N2 molecules.

Item
http://www.wikidata.org/entity/Q51620746
description
2008 nî lūn-bûn
@nan
2008年の論文
@ja
2008年学术文章
@wuu
2008年学术文章
@zh
2008年学术文章
@zh-cn
2008年学术文章
@zh-hans
2008年学术文章
@zh-my
2008年学术文章
@zh-sg
2008年學術文章
@yue
2008年學術文章
@zh-hant
name
Molecular applications of stat ...... 2O, H2S, C2, and N2 molecules.
@en
Molecular applications of stat ...... 2O, H2S, C2, and N2 molecules.
@nl
type
label
Molecular applications of stat ...... 2O, H2S, C2, and N2 molecules.
@en
Molecular applications of stat ...... 2O, H2S, C2, and N2 molecules.
@nl
prefLabel
Molecular applications of stat ...... 2O, H2S, C2, and N2 molecules.
@en
Molecular applications of stat ...... 2O, H2S, C2, and N2 molecules.
@nl
P1433
P1476
P2093
P2860
P304
P31
P356
P407
P433
P478
P577
P5875
P698
P356
P1433
P1476
Molecular applications of stat ...... 2O, H2S, C2, and N2 molecules.
@en
P2093
P2860
P304
P31
P356
P407
P433
P478
P577
P5875
P698