7 citations · 16 across the 5 of their papers we have counts for
6 papers
Possible applications of Mo2C in the orthorhombic and hexagonal phases explored via ab-initio investigations of elastic, bonding, optoelectronic and thermophysical properties
M. I. Naher, S. H. Naqib
Binary carbides demonstrate attractive set of physical properties that are suitable for numerous and diverse applications. In the present study, we have explored the structural pro…
A comprehensive DFT based insights into the physical properties of tetragonal Mo5PB2
M. I. Naher, M. A. Afzal, S. H. Naqib
Tetragonal Mo5PB2 compound, a recently discovered superconductor, belongs to technologically important class of materials. It is quite surprising to note that a large number of phy…
A comprehensive study of the physical properties of Nb2P5 via ab-initio technique
M. I. Naher, S. H. Naqib
Binary metallic phosphide, Nb2P5, belongs to technologically important class of materials. Quite surprisingly, a large number of physical properties of Nb2P5, including elastic pro…
Structural, elastic, electronic, bonding, thermal, and optical properties of topological Weyl semimetal TaX (X = P, As): Insights from ab-initio calculations
M. I. Naher, S. H. Naqib
In this work, we have studied the structural, elastic, mechanical, electronic, bonding, acoustic, thermal and optical properties of TaX (X = P, As) in detail via first-principles m…
Structural, elastic, electronic, bonding, and optical properties of topological CaSn3 semimetal
M. I. Naher, S. H. Naqib
The topological Weyl semimetal CaSn3, belonging to the AuCu3 type cubic structure, is an important electronic system to investigate both from the point of view of fundamental physi…
Structural, elastic, electronic, and bonding properties of intermetallic Nb3Pt and Nb3Os compounds: a DFT study
M. I. Naher, F. Parvin, A. K. M. A. Islam +1
Theoretical investigation of structural, elastic, electronic and bonding properties of A-15 Nb-based intermetallic compounds Nb3B (B = Pt, Os) have been performed using first princ…