First-principles calculations of structural, elastic, electronic and transport properties of vanadium-doped zirconium lead carbide max phase

First-principles calculations have been used to systematically investigate the structural, electronic, elastic, thermodynamic, and transport properties of Zr2PbC MAX phase and its alloys. The V-based alloys (VxZri-x)2PbC, 0 < x < 1 were synthesized by substituting V on the M-site of the MAX ph...

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Bibliographic Details

Main Author:	Ahams, Summanuwa Timothy
Format:	Thesis
Language:	English
Published:	2022
Subjects:	QC Physics
Online Access:	http://eprints.utm.my/101783/1/SummanuwaTimothyAhamspsPFS2022.pdf.pdf