Efficient algorithm for two-center Coulomb and exchange integrals of electronic prolate spheroidal orbitals (Q450197)
From MaRDI portal
scientific article
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | Efficient algorithm for two-center Coulomb and exchange integrals of electronic prolate spheroidal orbitals |
scientific article |
Statements
Efficient algorithm for two-center Coulomb and exchange integrals of electronic prolate spheroidal orbitals (English)
0 references
13 September 2012
0 references
Schrödinger equation
0 references
Coulomb integrals
0 references
prolate spheroidal coordinates
0 references
diatomic molecules
0 references
molecular orbitals
0 references
Laguerre expansions
0 references
0 references
0 references
