Ab initio study of a Bi 3+ impurity in Cs 2NaYCl 6 and Y 2O 3: Comparison of perturbative and variational electron correlation methods

Journal of Chemical Physics

Volumn 125, Issue 17, 2006, Pages

  Réal, Florent ^a,b   Vallet, Valérie ^a   Flament, Jean Pierre ^a   Schamps, Joël ^a  

^a UNIVERSITÉ DES SCIENCES ET TECHNOLOGIES DE LILLE   (France)

^b ALBANOVA UNIVERSITY CENTER   (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

EXCITATION ENERGIES; OSCILLATOR STRENGTHS; SPIN ORBIT CONFIGURATION INTERACTION; VARIATIONAL ELECTRON CORRELATION METHODS;

CESIUM COMPOUNDS; CORRELATION METHODS; ELECTRONIC STRUCTURE; GROUND STATE; IMPURITIES; PERTURBATION TECHNIQUES; YTTRIUM COMPOUNDS;

BISMUTH;

EID: 33750832372     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2361293     Document Type: Article

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