Multireference space without first solving the configuration interaction problem-Reference-Cited by-同舟云学术

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Multireference space without first solving the configuration interaction problem

Published:2013-12-03 Issue:4 Volume:35 Page:313-323
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J. Comput. Chem.

Author:

Glushkov Vitaly N.¹,Assfeld Xavier²

Affiliation:

1. Department of Physics; Electronics and Computer Systems; Oles Gonchar Dnipropetrovsk National University; Dnipropetrovsk Ukraine

2. Théorie-Modélisation-Simulation; UMR CNRS 7565; Faculté des Sciences et Technologies; Université de Lorraine; 54506 Vandoeuvre-lès-Nancy France

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Reference65 articles.

1. A perturbative correction to restricted open shell configuration interaction with single substitutions for excited states of radicals

2. Test applications of a new SCF method for excited states

3. A variationally stable compact Hartree–Fock-style wavefunction for a non-degenerate first excited state

4. Open-shell Møller–Plesset perturbation theory based on the asymptotic method of obtaining SCF orbitals

5. Application of the local self-consistent-field method to core-ionized and core-excited molecules, polymers, and proteins: True orthogonality between ground and excited states

Cited by 1 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. On the orthogonality of states with approximate wavefunctions;Journal of Molecular Modeling;2019-05-07

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