A posteriori localization of many‐body excited states through simultaneous diagonalization.
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- Journal of Computational Chemistry, 2023, v. 44, n. 2, p. 105, doi. 10.1002/jcc.27019
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- Publication type:
- Article
Works matching IS 01928651 AND DT 2023 AND VI 44 AND IP 2
Results: 5
1
2
Advancing molecular graphs with descriptors for the prediction of chemical reaction yields.
- Published in:
- Journal of Computational Chemistry, 2023, v. 44, n. 2, p. 76, doi. 10.1002/jcc.27016
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- Publication type:
- Article
3
How deeply are core electrons perturbed when valence electrons are spin polarized? The case study of transition metal compounds.
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- Journal of Computational Chemistry, 2023, v. 44, n. 2, p. 65, doi. 10.1002/jcc.27015
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- Publication type:
- Article
4
Issue Information.
- Published in:
- Journal of Computational Chemistry, 2023, v. 44, n. 2, p. 61, doi. 10.1002/jcc.26896
- Publication type:
- Article
5
Reactive orbital energy theory serving a theoretical foundation for the electronic theory of organic chemistry.
- Published in:
- Journal of Computational Chemistry, 2023, v. 44, n. 2, p. 93, doi. 10.1002/jcc.27017
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- Publication type:
- Article