Elastic constants of -eucryptite studied by density functional theory
نویسندگان
چکیده
Badri Narayanan,1 Ivar E. Reimanis,1 Edwin R. Fuller, Jr.,2 and Cristian V. Ciobanu3,* 1Department of Metallurgy & Materials Engineering, Colorado School of Mines, Golden, Colorado 80401, USA 2Ceramics Division, National Institute of Standards and Technology, Gaithersburg, Maryland 20899, USA 3Division of Engineering, Colorado School of Mines, Golden, Colorado 80401, USA Received 2 January 2010; revised manuscript received 22 February 2010; published 15 March 2010
منابع مشابه
Elastic constants and their variation by pressure in the cubic PbTiO3 compound using IRelast computational package within the density functional theory
p.p1 {margin: 0.0px 0.0px 0.0px 0.0px; text-align: justify; font: 12.0px 'Times New Roman'} span.s1 {font: 12.0px 'B Nazanin'} p.p1 {margin: 0.0px 0.0px 0.0px 0.0px; text-align: justify; font: 12.0px 'Times New Roman'} span.s1 {font: 12.0px 'B Nazanin'} In this paper, we study the structural and electronic properties of the cubic PbTiO3 compound by using the density functional the...
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