𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Least-squares Gaussian expansions of atomic orbitals

✍ Scribed by F. R. Burden; R. M. Wilson

Publisher
Springer
Year
1972
Tongue
English
Weight
92 KB
Volume
27
Category
Article
ISSN
1432-2234

No coin nor oath required. For personal study only.

πŸ“œ SIMILAR VOLUMES

Exact Gaussian expansions of Slater-type
Exact Gaussian expansions of Slater-type atomic orbitals
✍ AndrΓ© Severo Pereira Gomes; RogΓ©rio Custodio πŸ“‚ Article πŸ“… 2002 πŸ› John Wiley and Sons 🌐 English βš– 97 KB

## Abstract Three exact Slater‐type function (STO) integral transforms are presented. The STO‐NG basis set can then be developed using either only 1s Gaussian functions, the same Gaussian exponents for each shell, or using the first Gaussian of each symmetry. The use of any of these three alternati

Calculation of molecular momentum distri
Calculation of molecular momentum distributions using gaussian expansions of slater-type atomic orbitals
✍ Anthony C. Tanner; Irving R. Epstein πŸ“‚ Article πŸ“… 1974 πŸ› Elsevier Science 🌐 English βš– 767 KB

Electronic momentum distributions and Compton profGes have been caieutated for a number of small pofyatomic molecuies in the STONG (N=3,4,5,6) approsimation. The gaussian expansions converge rapidly and give acceptable approximations to the corresponding ST0 values for most momentum space properties

Basis sets of gaussian and Slater-type a
Basis sets of gaussian and Slater-type atomic orbitals
✍ D.M. Silver πŸ“‚ Article πŸ“… 1970 πŸ› Elsevier Science 🌐 English βš– 464 KB

Em-opPen dc CaIcrtl Alomiqur cl Mol&rrIaire. CECAM. Bt?fin~~~d 506. 91 Cantpus d'Orsay. Fv-ance Receivcrl 9 October 1970 The'concept of constructing moleculnr wivcfunctions using basis sets whose members consist of both Slater-type and gaussian-type atomic orbit:ds is ex:lmined through pilot SCF cal