Structural analysis of the cyclic AlO2 and AlS2 systems in doublet and quartet states at density functional theory and the electron correlation levels

Journal of Chemical Physics

Volumn 113, Issue 10, 2000, Pages 4216-4229

  Bu, Yuxiang ^a,b   Song, Xinyu ^b  

^a SHANDONG UNIVERSITY   (China)

^b QUFU NORMAL UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ALUMINA; COMPUTATIONAL METHODS; CORRELATION METHODS; DISSOCIATION; PERTURBATION TECHNIQUES; REACTION KINETICS; SULFUR COMPOUNDS;

ALUMINUM SULFIDE; DENSITY FUNCTIONAL THEORY (DFT); ELECTRON CORRELATION; MOLLER-PLESSET THEORY;

ELECTRON ENERGY LEVELS;

EID: 0034622710     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1288386     Document Type: Article

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