A comparative ab initio study of the mechanical, dynamical and thermophysical characteristics of XC2 (X = La, Ce, Tb, Ho)
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DOI: 10.1016/j.vacuum.2021.110383
Abstract: Abstract The structural, mechanical, lattice dynamics and thermophysical characteristics of XC2 (X = La, Ce, Tb, Ho) have been theoretically investigate by means of density functional theory (DFT). The optimized lattice constants and elastic constants of XC2… read more here.
Keywords: initio study; characteristics xc2; study mechanical; comparative initio ... See more keywords