Energy level shifts in two-step spin-orbit coupling ab initio calculations

Chemical Physics Letters

Volumn 498, Issue 1-3, 2010, Pages 226-228

  Sánchez Sanz, Goar ^a   Barandiarán, Zoila ^a   Seijo, Luis ^b  

^a UNIVERSIDAD AUTÓNOMA DE MADRID   (Spain)

^b INSTITUTO NICOLÁS CABRERA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO CALCULATIONS; AVOIDED CROSSINGS; CONFIGURATION-INTERACTION CALCULATIONS; CONFIGURATIONAL SPACES; DYNAMIC CORRELATION; ENERGY LEVEL; ENERGY LEVEL SHIFT; LOW COSTS; NUCLEAR POSITIONS; SPIN ORBITS; SPIN-ORBIT COUPLINGS;

CALCULATIONS; ELECTRON ENERGY LEVELS; WAVE FUNCTIONS;

ORBITS;

EID: 77957016569     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2010.08.051     Document Type: Article

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