Fitting electron densities of molecules.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 25, n. 5, p. 881, doi. 10.1002/qua.560250510
- By:
- Publication type:
- Article
Works matching IS 00207608 AND DT 1984 AND VI 25 AND IP 5
Results: 12
1
2
Method of recurrent construction of Löwdin spin-adapted wave functions. IV. Matrix element evaluation problem.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 25, n. 5, p. 767, doi. 10.1002/qua.560250503
- By:
- Publication type:
- Article
3
Statistical representation of atomic systems structure. I. Total binding energy as a function of the relative information content.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 25, n. 5, p. 755, doi. 10.1002/qua.560250502
- By:
- Publication type:
- Article
4
A general formulation of the 'quantum chemical le Chatelier principle'.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 25, n. 5, p. 853, doi. 10.1002/qua.560250507
- By:
- Publication type:
- Article
5
The band structure of porphyrinatonickel(II). A semiempirical crystal orbital study based on the tight-binding formalism.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 25, n. 5, p. 817, doi. 10.1002/qua.560250506
- By:
- Publication type:
- Article
6
Masthead.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 25, n. 5, p. fmi, doi. 10.1002/qua.560250501
- Publication type:
- Article
7
Generalized Hellmann-Feynman and curvature theorems in classical and quantum mechanics.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 25, n. 5, p. 915, doi. 10.1002/qua.560250512
- By:
- Publication type:
- Article
8
The effect of an epoxide-nucleophile reaction upon hydrogen bonding involving the nucleophile.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 25, n. 5, p. 869, doi. 10.1002/qua.560250509
- By:
- Publication type:
- Article
9
Convergence problems in SCF calculations: Further applications of a new technique based on the use of inverse Fock operator.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 25, n. 5, p. 809, doi. 10.1002/qua.560250505
- By:
- Publication type:
- Article
10
Asymptotic analysis of exchange interactions.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 25, n. 5, p. 891, doi. 10.1002/qua.560250511
- By:
- Publication type:
- Article
11
Numerical solution of Hartree-Fock equations for a polyatomic molecule: Linear H<sub>3</sub> in momentum space.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 25, n. 5, p. 863, doi. 10.1002/qua.560250508
- By:
- Publication type:
- Article
12
Molecular theory of critical phenomena in aliphatic carboxylic acid monolayers.
- Published in:
- International Journal of Quantum Chemistry, 1984, v. 25, n. 5, p. 795, doi. 10.1002/qua.560250504
- By:
- Publication type:
- Article