256 citations · 1.5k across the 19 of their papers we have counts for
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First-principles investigation of Ag-, Co-, Cr-, Cu-, Fe-, Mn-, Ni-, Pd- and Rh-hexaaminobenzene 2D metal-organic frameworks
Bohayra Mortazavi, Masoud Shahrokhi, Meysam Makaremi +2
In the latest experimental advances, Ni-, Co- and Cu-HAB MOFs were synthesized in 2D forms, with high electrical conductivities and capacitances as well. Motivated by these experim…
N-, P-, As-triphenylene-graphdiyne: Strong and stable 2D semiconductors with outstanding capacities as anodes for Li-ion batteries
Bohayra Mortazavi, Masoud Shahrokhi, Mohamed E. Madjet +3
Since the first report of graphdiyne nanomembranes synthesis in 2010, different novel graphdiyne nanosheets have been fabricated. In a latest experimental advance, triphenylene-gra…
Boron-graphdiyne: superstretchable semiconductor with low thermal conductivity and ultrahigh capacity for Li, Na and Ca ions storage
Bohayra Mortazavi, Masoud Shahrokhi, Xiaoying Zhuang +1
Most recently, boron-graphdiyne, a π-conjugated two-dimensional (2D) structure made from merely sp carbon skeleton connected with boron atoms was successfully experimentally realiz…
N-Graphdiyne two-dimensional nanomaterials: Semiconductors with low thermal conductivity and high stretchability
Bohayra Mortazavi, Meysam Makaremi, Masoud Shahrokhi +2
We conducted density functional theory (DFT) and molecular dynamics simulations to explore the mechanical/failure, thermal conductivity and stability, electronic and optical proper…
Borophene hydride: a stiff 2D material with high thermal conductivity and attractive optical and electronic properties
Bohayra Mortazavi, Meysam Makaremi, Masoud Shahrokhi +4
Two-dimensional (2D) structures of boron atoms so called borophene, have recently attracted remarkable attention. In a latest exciting experimental study, a hydrogenated borophene…
Mechanical, optoelectronic and transport properties of single-layer Ca2N and Sr2N electrides
Bohayra Mortazavi, Golibjon R Berdiyorov, Masoud Shahrokhi +1
Electride materials offer attractive physical properties due to their loosely bound electrons. Ca2N, an electride in the two-dimensional (2D) form was successfully recently synthes…