Importance of spin-orbit coupling for the assignment of the photodetachment spectra of AuX2- (X = Cl, Br, and I)

ChemPhysChem

Volumn 7, Issue 3, 2006, Pages 723-727

  Mishra, Sabyashachi ^b   Vallet, Valerie ^a   Domcke, Wolfgang ^b  

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

^b TECHNICAL UNIVERSITY OF MUNICH   (Germany)

Author keywords

Ab initio calculations; Electronic structure; Photoelectron spectroscopy; Relativistic effects; Spin orbit coupling

Indexed keywords

CALCULATIONS; CHEMICAL ELEMENTS; ELECTRONIC STATES; ELECTRONIC STRUCTURE; PHOTOELECTRON SPECTROSCOPY; RELATIVITY;

AB INITIO CALCULATIONS; HALOGEN ATOMS; HEAVY ELEMENTS; PHOTODETACHMENT SPECTRUM; RELATIVISTIC EFFECTIVE CORE POTENTIALS; RELATIVISTIC EFFECTS; SPIN-ORBIT COUPLINGS; THEORETICAL STUDY;

ATOMS;

EID: 33645109183     PISSN: 14394235     EISSN: 14397641     Source Type: Journal    
DOI: 10.1002/cphc.200500554     Document Type: Article

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