Structural stability of boron clusters with octahedral and tetrahedral symmetries

Journal of Physical Chemistry A

Volumn 115, Issue 29, 2011, Pages 8204-8207

  Hayami, Wataru ^a   Otani, Shigeki ^a  

^a NATIONAL INSTITUTE FOR MATERIALS SCIENCE   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

BORON CLUSTERS; CLUSTER MODELS; DEFORMATION TEMPERATURES; FIRST-PRINCIPLES CALCULATION; HIGH STABILITY; ICOSAHEDRAL CLUSTERS; JAHN TELLER DISTORTIONS; META-STABLE STATE; MOLECULAR DYNAMICS SIMULATIONS; OCTAHEDRAL CLUSTERS; STRUCTURAL STABILITIES; TETRAHEDRAL SYMMETRY;

BLOCK CODES; BORON; BORON COMPOUNDS; CALCULATIONS; DEFORMATION; ELECTRONIC STRUCTURE; MOLECULAR DYNAMICS; POTENTIAL ENERGY; STABILITY;

BINDING ENERGY;

EID: 79960623988     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp204115x     Document Type: Article

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