Structural transition, dielectric and bonding properties of BeCN 2

Chinese Physics B

Volumn 20, Issue 1, 2011, Pages

  Gou, Hui Yang ^a   Gao, Fa Ming ^a   Zhang, Jing Wu ^a   Li, Zhi Ping ^a  

^a YANSHAN UNIVERSITY   (China)

Author keywords

bonding; dielectric; First principle electron theory

Indexed keywords

AMBIENT CONDITIONS; BONDING PROPERTY; BORN EFFECTIVE CHARGE; CHALCOPYRITE-TYPE; DIELECTRIC; DIELECTRIC CONSTANTS; DIRECT BAND GAP; ELASTIC PROPERTIES; ELECTRON DENSITIES; FIRST-PRINCIPLE ELECTRON THEORY; FIRST-PRINCIPLES; HARD MATERIAL; INDIRECT BAND GAP; OPTICAL WINDOW; POISSON'S RATIO; SHEAR MODULUS; SPACE GROUPS; STRUCTURAL TRANSITIONS; TETRAGONAL PHASE; TETRAGONAL STRUCTURE; TOTAL ENERGY; TOTAL ENERGY CALCULATION; TRANSPARENT SEMICONDUCTOR; VICKER HARDNESS; WEAR RESISTANT MATERIALS;

CUBIC BORON NITRIDE; DENSITY (SPECIFIC GRAVITY); DENSITY FUNCTIONAL THEORY; ELECTRONIC PROPERTIES; ELECTRONIC STRUCTURE; ENERGY GAP; HARDNESS; MECHANICAL PROPERTIES; POISSON RATIO;

STRUCTURAL PROPERTIES;

EID: 79952396614     PISSN: 16741056     EISSN: None     Source Type: Journal    
DOI: 10.1088/1674-1056/20/1/016201     Document Type: Article

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