Works matching IS 01928651 AND DT 2021 AND VI 42 AND IP 21
Results: 7
Solid‐state quantum chemistry with ΘΦ (ThetaPhi): Spin‐liquids, superconductors, and magnetic superstructures made computationally available.
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- Journal of Computational Chemistry, 2021, v. 42, n. 21, p. 1498, doi. 10.1002/jcc.26561
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- Article
Evolution of the linker in microhydrated hydrogen dinitrate anions: From H<sup>+</sup> to H<sub>5</sub>O<sub>2</sub><sup>+</sup>.
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- Journal of Computational Chemistry, 2021, v. 42, n. 21, p. 1514, doi. 10.1002/jcc.26560
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- Article
MonteCarbo: A software to generate and dock multifunctionalized ring molecules.
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- Journal of Computational Chemistry, 2021, v. 42, n. 21, p. 1526, doi. 10.1002/jcc.26559
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- Article
Accurate prediction of the properties of materials using the CAM‐B3LYP density functional.
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- Journal of Computational Chemistry, 2021, v. 42, n. 21, p. 1486, doi. 10.1002/jcc.26558
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- Article
Local current analysis on defective zigzag graphene nanoribbons devices for biosensor material applications.
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- Journal of Computational Chemistry, 2021, v. 42, n. 21, p. 1475, doi. 10.1002/jcc.26557
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- Article
Exploring the quality of protein structural models from a Bayesian perspective.
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- Journal of Computational Chemistry, 2021, v. 42, n. 21, p. 1466, doi. 10.1002/jcc.26556
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- Article
Issue Information.
- Published in:
- Journal of Computational Chemistry, 2021, v. 42, n. 21, p. 1461, doi. 10.1002/jcc.26305
- Publication type:
- Article