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cond-mat.mtrl-sci2012★ 907 cited
Quasiparticle band structures and optical properties of strained monolayer MoS2 and WS2
Hongliang Shi, Hui Pan, Yong-Wei Zhang +1
The quasiparticle (QP) band structures of both strainless and strained monolayer MoS are investigated using more accurate many body perturbation \emph{GW} theory and maximall…
cond-mat.mtrl-sci2012★ 230 cited
Dislocations and Grain Boundaries in Two-Dimensional Boron Nitride
Yuanyue Liu, Xiaolong Zou, Boris I. Yakobson
A new dislocation structure-square-octagon pair (4|8) is discovered in two-dimensional boron nitride (h-BN), via first-principles calculations. It has lower energy than correspondi…