✦ LIBER ✦

Molecular correlation integrals. Two center one electron integrals containing a function of interparticle distance in one center expansion approximation

✍ Scribed by Bhairav D. Joshi; K. L. Kapoor

Publisher: John Wiley and Sons
Year: 1969
Tongue: English
Weight: 756 KB
Volume: 3
Category: Article
ISSN: 0020-7608
DOI: 10.1002/qua.560030403

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Neglect of four- and approximation of on

Neglect of four- and approximation of one-, two-, and three-center two-electron integrals in a symmetrically orthogonalized basis

✍ Dimitri N. Laikov 📂 Article 📅 2006 🏛 John Wiley and Sons 🌐 English ⚖ 90 KB

## Abstract A new integral approximation for use in molecular electronic structure calculations is proposed as an alternative to the traditional neglect of diatomic differential overlap models. The similarity between the symmetrically orthogonalized and the original basis functions (assumed orthono

Applications of fourier transforms in mo

Applications of fourier transforms in molecular orbital theory. Calculation of optical properties and tables of two-center one-electron integrals

✍ John Avery; Michael Cook 📂 Article 📅 1974 🏛 Springer 🌐 English ⚖ 489 KB