First-principles examination of low tolerance factor perovskites.
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- International Journal of Quantum Chemistry, 2017, v. 117, n. 19, p. n/a, doi. 10.1002/qua.25420
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- Article
Works matching IS 00207608 AND DT 2017 AND VI 117 AND IP 19
Results: 8
1
2
Confinement effects on the electronic structure of M-shell atoms: A study with explicitly correlated wave functions.
- Published in:
- International Journal of Quantum Chemistry, 2017, v. 117, n. 19, p. n/a, doi. 10.1002/qua.25421
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- Publication type:
- Article
3
The chemical bonding and spectral assignments of rhodium(III)-catalyzed closo-dodecaborate complexes: Ab initio study.
- Published in:
- International Journal of Quantum Chemistry, 2017, v. 117, n. 19, p. n/a, doi. 10.1002/qua.25422
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- Publication type:
- Article
4
Issue Information.
- Published in:
- International Journal of Quantum Chemistry, 2017, v. 117, n. 19, p. n/a, doi. 10.1002/qua.25271
- Publication type:
- Article
5
Cover Image, Volume 117, Issue 19.
- Published in:
- International Journal of Quantum Chemistry, 2017, v. 117, n. 19, p. n/a, doi. 10.1002/qua.25272
- Publication type:
- Article
6
A hidden rule in metal sulfide fullerenes: A case study of Sc<sub>2</sub>S@C<sub>88</sub>.
- Published in:
- International Journal of Quantum Chemistry, 2017, v. 117, n. 19, p. n/a, doi. 10.1002/qua.25416
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- Publication type:
- Article
7
DSD-PBEP86-NL and DOD-PBEP86-NL functionals for noncovalent interactions: Basis set effects and tentative applications to large noncovalent systems.
- Published in:
- International Journal of Quantum Chemistry, 2017, v. 117, n. 19, p. n/a, doi. 10.1002/qua.25417
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- Publication type:
- Article
8
Dissociation of sulfur oxoacids by two water molecules studied using ab initio and density functional theory calculations.
- Published in:
- International Journal of Quantum Chemistry, 2017, v. 117, n. 19, p. n/a, doi. 10.1002/qua.25419
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- Publication type:
- Article