中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
Hardness of covalent crystals

文献类型:期刊论文

作者Gao FM ; He JL ; Wu ED ; Liu SM ; Yu DL ; Li DC ; Zhang SY ; Tian YJ
刊名physical review letters
出版日期2003
卷号91期号:1页码:文献编号:015502
关键词TRANSITION-METAL CARBIDES SUPERHARD MATERIALS CHEMICAL-BOND SOLIDS SEMICONDUCTORS NITRIDES DIAMOND MODULI
ISSN号0031-9007
通讯作者gao fm
中文摘要based on the idea that the hardness of covalent crystal is intrinsic and equivalent to the sum of the resistance to the indenter of each bond per unit area, a semiempirical method for the evaluation of hardness of multicomponent crystals is presented. applied to beta-bc2n crystal, the predicted value of hardness is in good agreement with the experimental value. it is found that bond density or electronic density, bond length, and degree of covalent bonding are three determinative factors for the hardness of a polar covalent crystal. our method offers the advantage of applicability to a broad class of materials and initializes a link between macroscopic property and electronic structure from first principles calculation.
收录类别SCI
语种英语
WOS记录号WOS:000183915400028
公开日期2010-09-13
源URL[http://202.98.16.49/handle/322003/17687]  
专题长春应用化学研究所_长春应用化学研究所知识产出_期刊论文
推荐引用方式
GB/T 7714
Gao FM,He JL,Wu ED,et al. Hardness of covalent crystals[J]. physical review letters,2003,91(1):文献编号:015502.
APA Gao FM.,He JL.,Wu ED.,Liu SM.,Yu DL.,...&Tian YJ.(2003).Hardness of covalent crystals.physical review letters,91(1),文献编号:015502.
MLA Gao FM,et al."Hardness of covalent crystals".physical review letters 91.1(2003):文献编号:015502.

入库方式: OAI收割

来源:长春应用化学研究所

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