Étude théorique des molécules diatomiques BN, SiN et LaH, structure électronique et spectroscopie

Étude théorique des molécules diatomiques BN, SiN et LaH, structure électronique et spectroscopie

Une étude théorique ab initio des structures électroniques des molécules Diatomiques polaires BN, SiN et LaH dans la représentation 2s+1Λ(+/-)Ont été effectués par la méthode du champ auto-cohérent de l'espace Actif complet (CASSCF), suivie par l'interaction de la configuration multiréfér...

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Bibliographic Details
Main Author:	Mahmoud, Salman
Other Authors:	Montpellier 2
Language:	en
Published:	2014
Subjects:	Molécules diatomiques Calculs Ab initio Configuration Interaction Multiréférence Constants Spectroscopique Moment électrique dipolaire de l’electron Spin Orbite-Effets Diatomic molecules Ab initio Calculations Multireference Configuration Interaction Spectroscopic Constants Electric Dipole Moment of the electron Spin-Orbit effects
Online Access:	http://www.theses.fr/2014MON20080/document

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