583 citations · 2.3k across the 34 of their papers we have counts for
4 papers · 1 filter
Dimensionality driven charge density wave instability in TiS
Kapildeb Dolui, Stefano Sanvito
Density functional theory and density functional perturbation theory are used to investigate the electronic and vibrational properties of TiS. Within the local density approxim…
Electric Field Effects on Armchair MoS2 Nanoribbons
Kapildeb Dolui, Chaitanya Das Pemmaraju, Stefano Sanvito
{\it Ab initio} density functional theory calculations are performed to investigate the electronic structure of MoS armchair nanoribbons in the presence of an external static e…
Ab-initio study on the possible doping strategies for MoS monolayers
Kapildeb Dolui, Ivan Rungger, Chaitanya Das Pemmaraju +1
Density functional theory is used to systematically study the electronic and magnetic properties of doped MoS monolayers, where the dopants are incorporated both via S/Mo subst…
Origin of the n-type and p-type conductivity of MoS2 monolayers on a SiO2 substrate
Kapildeb Dolui, Ivan Rungger, Stefano Sanvito
Ab-initio density functional theory calculations are performed to study the electronic properties of a MoS2 monolayer deposited over a SiO2 substrate in the presence of interface i…