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Showing 2006 · cond-mat.mtrl-sciShow all
2 papers · 2 filters
cond-mat.mtrl-sci2006★ 167 cited
Potential super-hard Osmium di-nitride with fluorite structure: First-principles calculations
Chang-Zeng Fan, Song-Yan Zeng, Li-Xin Li +4
We have performed systematic first-principles calculations on di-carbide, -nitride, -oxide and -boride of platinum and osmium with the fluorite structure. It is found that only PtN…
cond-mat.mtrl-sci2006★ 60 cited
Low compressible noble metal carbides with rock-salt structure: ab initio total energy calculations of the elastic stability
Chang-Zeng Fan, Song-Yan Zeng, Zai-Ji Zhan +4
We have systematically studied the mechanical stability of all noble metal carbides with the rock-salt structure by calculating their elastic constants within the density function…