𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Self-consistent structure in a relativistic Dirac–Hartree–Fock approximation

✍ Scribed by Hiroshi Uechi

Publisher
Elsevier Science
Year
2001
Tongue
English
Weight
155 KB
Volume
696
Category
Article
ISSN
0375-9474

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Self-consistent embedded-cluster calcula
Self-consistent embedded-cluster calculations of the electronic structure of alkaline earth fluorides in the hartree-fock-slater approximation
✍ N. C. Amaral; B. Maffeo; Diana Guenzburger 📂 Article 📅 1983 🏛 John Wiley and Sons 🌐 English ⚖ 655 KB

## Abstract Molecular orbital calculations are performed for clusters representing the CaF~2~, SrF~2~, and BaF~2~ ionic crystals. The discrete variational method is employed, with the Xα approximation for the exchange interaction; a detailed investigation of different models for embedding the clust