Interaction of copernicium with gold: Assessment of applicability of simple density functional theories.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 13, p. 1772, doi. 10.1002/qua.24429
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- Publication type:
- Article
Works matching IS 00207608 AND DT 2013 AND VI 113 AND IP 13
Results: 8
1
2
Small changes-Huge influences: NMR chemical shifts of Ni(II) complexes with polar substrates.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 13, p. 1787, doi. 10.1002/qua.24401
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- Publication type:
- Article
3
Importance of Pd and Pt excited states in N<sub>2</sub>O capture and activation: A comparative study with Rh and Au atoms.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 13, p. 1794, doi. 10.1002/qua.24405
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- Publication type:
- Article
4
Inside Cover, Volume 113, Issue 13.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 13, p. iii, doi. 10.1002/qua.24477
- Publication type:
- Article
5
Cover Image, Volume 113, Issue 13.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 13, p. i, doi. 10.1002/qua.24476
- Publication type:
- Article
6
Unpaired electrons at the second-order reduced density matrix level: Covalent bonding, and coulomb and fermi correlations in closed shell systems.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 13, p. 1775, doi. 10.1002/qua.24399
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- Publication type:
- Article
7
Density dynamics in some quantum systems.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 13, p. 1747, doi. 10.1002/qua.24402
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- Publication type:
- Article
8
Assessing the performance of density functional theory for the dynamic polarizabilities of amino acids: Treatment of correlation and role of exact exchange.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 13, p. 1803, doi. 10.1002/qua.24406
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- Publication type:
- Article