147 citations · 349 across the 5 of their papers we have counts for
5 papers
Enhancement in hydrogen storage capacities of light metal functionalized Boron Graphdiyne nanosheets
T. Hussain, B. Mortazavi, H. Bae +3
The recent experimental synthesis of the two-dimensional (2D)boron-graphdiyne (BGDY) nanosheet has motivated us to investigate its structural, electronic,and energy storage propert…
Theoretical realization of two-dimensional M3(C6X6)2(M= Co, Cr, Cu, Fe, Mn, Ni, Pd, Rh and X= O, S, Se) metal-organic frameworks
Bohayra Mortazavi, Masoud Shahrokhi, Tanveer Hussain +2
Most recently, Cu-hexahydroxybenzene MOF was for the time experimentally realized, through a kinetically controlled approach. Cu-HHB belongs to the family of conductive MOFs with a…
N-, B-, P-, Al-, As-, Ga-graphdiyne/graphyne lattices: First-principles investigation of mechanical, optical and electronic properties
B. Mortazavi, M. Shahrokhi, M. E. Madjet +3
Graphdiyne and graphyne are carbon-based two-dimensional (2D) porous atomic lattices, with outstanding physics and excellent application prospects for advanced technologies, like n…
Polylithiated (OLi2) functionalized graphane as a potential hydrogen storage material
Tanveer Hussain, Tuhina Adit Maark, Abir De Sarkar +1
Hydrogen storage capacity, stability, bonding mechanism and the electronic structure of polylithiated molecules (OLi2) functionalized graphane (CH) has been studied by means of fir…
Strain induced lithium functionalized graphane as a high capacity hydrogen storage material
Tanveer Hussain, Abir De Sarkar, Rajeev Ahuja
Strain effects on the stability, electronic structure, and hydrogen storage capacity of lithium-doped graphane (CHLi) have been investigated by stateof-the art first principle dens…