First principles studies on the structures, electronic states and stability of Sin-mCm clusters

Journal of Molecular Structure: THEOCHEM

Volumn 621, Issue 3, 2003, Pages 279-284

  Jiang, Zhenyi ^a,b   Xu, Xiaohong ^b   Wu, Haishun ^b   Zhang, Fuqiang ^b   Jin, Zhihao ^a  

^a XI'AN JIAOTONG UNIVERSITY   (China)

^b SHANXI NORMAL UNIVERSITY   (China)

Author keywords

DFT theory; Geometric configuration; Ground state; Sin 1C and Sin 2C2 clusters; Stability

Indexed keywords

SILICON CARBIDE;

ARTICLE; CALCULATION; CHEMICAL BOND; DENSITY; FREQUENCY ANALYSIS; ISOMER; MOLECULAR STABILITY; PREDICTION;

EID: 0037470296     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(02)00643-7     Document Type: Article

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