Integral approximations for LCAO-SCF calculations
- 1 October 1993
- journal article
- Published by Elsevier in Chemical Physics Letters
- Vol. 213 (5-6) , 514-518
- https://doi.org/10.1016/0009-2614(93)89151-7
Abstract
No abstract availableThis publication has 7 references indexed in Scilit:
- Use of approximate integrals in ab initio theory. An application in MP2 energy calculationsChemical Physics Letters, 1993
- Density matrix averaged atomic natural orbital (ANO) basis sets for correlated molecular wave functionsTheoretical Chemistry Accounts, 1990
- On the gaussian-type orbitals approach to local density functional theoryJournal de Chimie Physique et de Physico-Chimie Biologique, 1989
- Ab initio calculations on large molecules: The multiplicative integral approximationJournal of Computational Chemistry, 1988
- Solution of the Hartree–Fock equations for polyatomic molecules by a pseudospectral methodThe Journal of Chemical Physics, 1987
- One- and two-electron integrals over cartesian gaussian functionsJournal of Computational Physics, 1978
- Simplifications in the generation and transformation of two‐electron integrals in molecular calculationsInternational Journal of Quantum Chemistry, 1977