Predicting two-dimensional boron-carbon compounds by the global optimization method

Journal of the American Chemical Society

Volumn 133, Issue 40, 2011, Pages 16285-16290

  Luo, Xinyu ^a   Yang, Jihui ^a   Liu, Hanyu ^b   Wu, Xiaojun ^c   Wang, Yanchao ^b   Ma, Yanming ^b   Wei, Su Huai ^d   Gong, Xingao ^a   Xiang, Hongjun ^a  

^a FUDAN UNIVERSITY   (China)

^b JILIN UNIVERSITY   (China)

^c UNIVERSITY OF SCIENCE AND TECHNOLOGY OF CHINA   (China)

^d NATIONAL RENEWABLE ENERGY LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

2D STRUCTURES; BORON ATOM; BORON CONCENTRATIONS; BORON-DOPED GRAPHENE; GLOBAL OPTIMIZATION METHOD; HIGH THERMAL STABILITY; SIX-MEMBERED RINGS; STABLE STRUCTURES; ZIGZAG CHAINS;

ATOMS; FORECASTING; GLOBAL OPTIMIZATION; GRAPHENE; PARTICLE SWARM OPTIMIZATION (PSO); TWO DIMENSIONAL;

BORON;

BORON; CARBON; GRAPHENE; NANOMATERIAL;

ARTICLE; ATOM; CHEMICAL BOND; CRYSTAL STRUCTURE; DENSITY FUNCTIONAL THEORY; MOLECULAR DYNAMICS; SEMICONDUCTOR; TEMPERATURE; THERMOSTABILITY;

EID: 80053519497     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja2072753     Document Type: Article

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