Comprehensive relativistic Ab initio and density functional theory studies on PtH, PtF, PtCl, and Pt(NH3)2Cl2

Journal of Computational Chemistry

Volumn 23, Issue 5, 2002, Pages 564-575

  Liu, Wenjian ^a,b   Franke, Robert ^a,c  

^a PEKING UNIVERSITY   (China)

^b RUHR UNIVERSITY BOCHUM   (Germany)

^c Infracor GmbH   (Germany)

Author keywords

BDF; CCSD(T); cis and trans platin; Correlation; DFT; DPT; ECP; Excitation energy; Platinum diatomics; Relativity; Spectroscopic constants

Indexed keywords

EID: 0037089546     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/jcc.10030     Document Type: Article

References (67)