论文标题

某些二元过渡金属碳化物XC(X = NB,TA,TI)的物理特性的比较分析:一项全面的AB-Initio研究的见解

Comparative analysis of physical properties of some binary transition metal carbides XC (X = Nb, Ta, Ti): Insights from a comprehensive ab-initio study

论文作者

Ahmed, Razu, Mahamudujjaman, Md., Afzal, Md. Asif, Islam, Md. Sajidul, Islam, R. S., Naqib, S. H.

论文摘要

二进制金属碳化物属于技术上突出的材料类别。我们已经探索了XC(X = NB,TA,TI)二元金属碳化物的结构,机械,电子,光学和某些热物理性质,并采用了第一原理方法的细节。获得的一些结果是新颖的。已经进行了比较分析。

Binary metallic carbides belong to a technologically prominent class of materials. We have explored the structural, mechanical, electronic, optical, and some thermophysical properties of XC (X = Nb, Ta, Ti) binary metallic carbides in details employing first-principles method. Some of the results obtained are novel. A comparative analysis has been made.

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