Convergence properties of Hartree-Fock SCF molecular calculations.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 26, n. 6, p. 1039, doi. 10.1002/qua.560260608
- By:
- Publication type:
- Article
Works matching IS 00207608 AND DT 1984 AND VI 26 AND IP 6
Results: 9
1
2
The metric properties of the reduced nuclear configuration space.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 26, n. 6, p. 983, doi. 10.1002/qua.560260603
- By:
- Publication type:
- Article
3
Solution of a correlation function's defining integral equation for complex domains.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 26, n. 6, p. 987, doi. 10.1002/qua.560260604
- By:
- Publication type:
- Article
4
Statistical computer-aided calculation of molecular integrals.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 26, n. 6, p. 1029, doi. 10.1002/qua.560260607
- By:
- Publication type:
- Article
5
Many-electron theory of autoionizing states using complex coordinates: The position and the partial and total widths of the Ne<sup>+</sup> 1 s hole state.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 26, n. 6, p. 1017, doi. 10.1002/qua.560260606
- By:
- Publication type:
- Article
6
Masthead.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 26, n. 6, p. fmi, doi. 10.1002/qua.560260601
- Publication type:
- Article
7
Effective basis sets for calculations of exchange-repulsion energy.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 26, n. 6, p. 971, doi. 10.1002/qua.560260602
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- Publication type:
- Article
8
A classification of polyenes into 4 L + 2- and 4 L-classes on the basis of Coulson's bond orders and information theory and its application to the interpretation of electrocyclic reactions.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 26, n. 6, p. 993, doi. 10.1002/qua.560260605
- By:
- Publication type:
- Article
9
Semiempirical estimates of static multipole polarizabilities for free atoms.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 26, n. 6, p. 1051, doi. 10.1002/qua.560260609
- By:
- Publication type:
- Article