Phase Stability, Physical Properties, and Hardness of Transition-Metal Diborides MB2 (M = Tc, W, Re, and Os): First-Principles Investigations

2013 ◽  
Vol 117 (20) ◽  
pp. 10643-10652 ◽  
Author(s):  
Ming-Min Zhong ◽  
Xiao-Yu Kuang ◽  
Zhen-Hua Wang ◽  
Peng Shao ◽  
Li-Ping Ding ◽  
...  
Keyword(s):  
Transition Metal ◽  
Physical Properties ◽  
Phase Stability ◽  
First Principles ◽  
Metal Diborides ◽  
Transition Metal Diborides

First-principles modeling of hardness in transition-metal diborides

2009 ◽  
Vol 80 (1) ◽  
Author(s):  
Petr Lazar ◽  
Xing-Qiu Chen ◽  
Raimund Podloucky
Keyword(s):  
Transition Metal ◽  
First Principles ◽  
Metal Diborides ◽  
Transition Metal Diborides

First-Principles Prediction on the High-Pressure Structures of Transition Metal Diborides (TMB2, TM = Sc, Ti, Y, Zr)

2010 ◽  
Vol 49 (15) ◽  
pp. 6859-6864 ◽  
Author(s):  
Meiguang Zhang ◽  
Hui Wang ◽  
Hongbo Wang ◽  
Xinxin Zhang ◽  
Toshiaki Iitaka ◽  
...  
Keyword(s):  
High Pressure ◽  
Transition Metal ◽  
First Principles ◽  
Metal Diborides ◽  
Transition Metal Diborides

ChemInform Abstract: First-Principles Prediction on the High-Pressure Structures of Transition Metal Diborides (TMB2, TM: Sc, Ti, Y, Zr).

ChemInform ◽  
2010 ◽  
Vol 41 (38) ◽  
pp. no-no
Author(s):  
Meiguang Zhang ◽  
Hui Wang ◽  
Hongbo Wang ◽  
Xinxin Zhang ◽  
Toshiaki Iitaka ◽  
...  
Keyword(s):  
High Pressure ◽  
Transition Metal ◽  
First Principles ◽  
Metal Diborides ◽  
Transition Metal Diborides

Trends in elasticity and electronic structure of 5d transition metal diborides: first-principles calculations

2007 ◽  
Vol 19 (19) ◽  
pp. 196212 ◽  
Author(s):  
Xianfeng Hao ◽  
Zhijian Wu ◽  
Yuanhui Xu ◽  
Defeng Zhou ◽  
Xiaojuan Liu ◽  
...  
Keyword(s):  
Electronic Structure ◽  
Transition Metal ◽  
First Principles ◽  
First Principles Calculations ◽  
Metal Diborides ◽  
Transition Metal Diborides
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