Non-nuclear attractors on Si-Si bond in quantum-chemical modeling as basis set inadequacy

Chemical Physics

Volumn 288, Issue 2-3, 2003, Pages 159-169

  Zhikol, O A ^a   Oshkalo, A F ^a   Shishkin, O V ^a   Prezhdo, O V ^b  

^a INSTITUTE FOR SINGLE CRYSTALS   (Ukraine)

^b UNIVERSITY OF WASHINGTON   (United States)

Author keywords

Basis set inadequacy; Disilane molecule; Electron density; Nonnuclear attractor; Topological analysis

Indexed keywords

SILICON;

ANALYTIC METHOD; ARTICLE; CHEMICAL ANALYSIS; CHEMICAL BOND; CHEMICAL INTERACTION; CHEMICAL MODEL; CORRELATION ANALYSIS; DENSITY; ELECTRON; NUCLEAR REACTOR; QUANTUM CHEMISTRY; THEORY;

EID: 0037443962     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0301-0104(03)00006-5     Document Type: Article

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