Theoretical analysis on TiO<sub>2</sub>(110)/V surface.
- Published in:
- International Journal of Quantum Chemistry, 2001, v. 85, n. 1, p. 44, doi. 10.1002/qua.1098
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- Publication type:
- Article
Works matching IS 00207608 AND DT 2001 AND VI 85 AND IP 1
Results: 7
1
2
Density functional study of small Ni<sub> n</sub> clusters, with n=2-6, 8, using the generalized gradient approximation.
- Published in:
- International Journal of Quantum Chemistry, 2001, v. 85, n. 1, p. 22, doi. 10.1002/qua.1080
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- Publication type:
- Article
3
EHF theory of chemical reactions V. Nature of manganese-oxygen bonds by hybrid density functional theory (DFT) and coupled-cluster (CC) methods.
- Published in:
- International Journal of Quantum Chemistry, 2001, v. 85, n. 1, p. 34, doi. 10.1002/qua.1099
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- Publication type:
- Article
4
Approximate solution of the representability problem.
- Published in:
- International Journal of Quantum Chemistry, 2001, v. 85, n. 1, p. 1, doi. 10.1002/qua.1094
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- Publication type:
- Article
5
Erratum.
- Published in:
- International Journal of Quantum Chemistry, 2001, v. 85, n. 1, p. 61, doi. 10.1002/qua.2000
- Publication type:
- Article
6
A note on nodal structures, partial screening, and periodic trends among alkali metals and alkaline earths.
- Published in:
- International Journal of Quantum Chemistry, 2001, v. 85, n. 1, p. 18, doi. 10.1002/qua.1096
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- Publication type:
- Article
7
Möbius aromaticity in small [ n] trans-annulenes?
- Published in:
- International Journal of Quantum Chemistry, 2001, v. 85, n. 1, p. 52, doi. 10.1002/qua.1089
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- Publication type:
- Article