Development of molecular cluster models to probe pyrite surface reactivity.
- Published in:
- Journal of Computational Chemistry, 2023, v. 44, n. 32, p. 2486, doi. 10.1002/jcc.27213
- By:
- Publication type:
- Article
Works matching IS 01928651 AND DT 2023 AND VI 44 AND IP 32
Results: 6
1
2
Relativistic adapted Gaussian basis sets free of variational prolapse of small and medium size for cesium through radon.
- Published in:
- Journal of Computational Chemistry, 2023, v. 44, n. 32, p. 2478, doi. 10.1002/jcc.27212
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- Publication type:
- Article
3
Toward a correct treatment of core properties with local hybrid functionals.
- Published in:
- Journal of Computational Chemistry, 2023, v. 44, n. 32, p. 2461, doi. 10.1002/jcc.27211
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- Publication type:
- Article
4
Crystal structures and P–T phase diagrams of SrC2O5 and BaC2O5.
- Published in:
- Journal of Computational Chemistry, 2023, v. 44, n. 32, p. 2453, doi. 10.1002/jcc.27210
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- Publication type:
- Article
5
Study of mechanical, optical, and thermoelectric characteristics of Ba<sub>2</sub>XMoO<sub>6</sub> (X = Zn, Cd) double perovskite for energy harvesting.
- Published in:
- Journal of Computational Chemistry, 2023, v. 44, n. 32, p. 2442, doi. 10.1002/jcc.27209
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- Publication type:
- Article
6
Issue Information.
- Published in:
- Journal of Computational Chemistry, 2023, v. 44, n. 32, p. 2437, doi. 10.1002/jcc.26926
- Publication type:
- Article