Works matching IS 01928651 AND DT 2020 AND VI 41 AND IP 23
Results: 8
Interactions of CO<sub>2</sub> with cluster models of metal–organic frameworks.
- Published in:
- Journal of Computational Chemistry, 2020, v. 41, n. 23, p. 2066, doi. 10.1002/jcc.26377
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- Article
Quantum chemical topology at the spin–orbit configuration interaction level: Application to astatine compounds.
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- Journal of Computational Chemistry, 2020, v. 41, n. 23, p. 2055, doi. 10.1002/jcc.26373
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- Article
Chalcogen–mercury bond formation and disruption in model Rabenstein's reactions: A computational analysis.
- Published in:
- Journal of Computational Chemistry, 2020, v. 41, n. 23, p. 2045, doi. 10.1002/jcc.26371
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- Article
SuSMoST: Surface Science Modeling and Simulation Toolkit.
- Published in:
- Journal of Computational Chemistry, 2020, v. 41, n. 23, p. 2084, doi. 10.1002/jcc.26370
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- Article
Photochemistry in the strong coupling regime: A trajectory surface hopping scheme.
- Published in:
- Journal of Computational Chemistry, 2020, v. 41, n. 23, p. 2033, doi. 10.1002/jcc.26369
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- Article
Diels‐Alder reaction mechanisms of substituted chiral anthracene: A theoretical study based on the reaction force and reaction electronic flux.
- Published in:
- Journal of Computational Chemistry, 2020, v. 41, n. 23, p. 2022, doi. 10.1002/jcc.26360
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- Article
Issue Information.
- Published in:
- Journal of Computational Chemistry, 2020, v. 41, n. 23, p. 2017, doi. 10.1002/jcc.25964
- Publication type:
- Article
Cover Image, Volume 41, Issue 23.
- Published in:
- Journal of Computational Chemistry, 2020, v. 41, n. 23, p. C1, doi. 10.1002/jcc.25963
- Publication type:
- Article