𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Generalized relativistic effective core potential calculations of the adiabatic potential curve and spectroscopic constants for the ground electronic state of the Ca 2 molecule

✍ Scribed by Mosyagin, Nikolai S.; Petrov, Aleksander N.; Titov, Anatoly V.; Zaitsevskii, Andrei V.

Book ID
120169826
Publisher
John Wiley and Sons
Year
2013
Tongue
English
Weight
158 KB
Volume
113
Category
Article
ISSN
0020-7608

No coin nor oath required. For personal study only.

πŸ“œ SIMILAR VOLUMES

Relativistic effective potential Cl calc
Relativistic effective potential Cl calculations including spinβ€”orbit coupling for the ground state of Bi2
✍ P.A. Christiansen πŸ“‚ Article πŸ“… 1984 πŸ› Elsevier Science 🌐 English βš– 427 KB

The dissociation curve and spectroscopic properties for the 0: gound state of Biz have been computed from configuration interaction calculations including relativistic effects. The Dzand we values are in good areement with experiment. The spin-orbit coupling mixes in subsianrial 3~g character (about

Pseudo-potential evaluation of the groun
Pseudo-potential evaluation of the ground-state potential curves for the Cl2 and Br2 molecules
✍ G. Das πŸ“‚ Article πŸ“… 1981 πŸ› Elsevier Science 🌐 English βš– 371 KB

The electronrc wavefunctlons and potential tunes for the ground states of the Cl2 and Brz molecules are calculated usmg pseudo-potent& techmques The agreement with experunent for both molecules IS sattiactory For Cl2 all-electron calcuhtlons are also performed as a study of the accuracy of the pseud