Range-separated density functional theory: A 4-component relativistic study of the rare gas dimers He 2, Ne 2, Ar 2, Kr 2, Xe 2, Rn 2 and Uuo 2

Chemical Physics

Volumn 395, Issue 1, 2012, Pages 54-62

  Kullie, Ossama ^a   Saue, Trond ^b  

^a UNIVERSITÉ DE STRASBOURG   (France)

^b CNRS   (France)

Author keywords

Argon; Density functional theory; Dispersion forces; Electron correlations; Element 118; Helium; Inert gases; Intermolecular mechanics; Krypton; Neon; Radon; Rare gas dimers; Relativistic electronic structure theory; SCF calculations; Second order M ller Plesset perturbation theory; Spectroscopic constants; Spin orbit interactions; Wave functions

Indexed keywords

EID: 84857049739     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.chemphys.2011.06.024     Document Type: Conference Paper

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