most citedDirect calculation of the linear thermal expansion coefficients of MoS2 via symmetry-preserving deformations

50 citations · 50 across the 1 of their papers we have counts for

collaborators

1 paper

cond-mat.mtrl-sci2016★ 50 cited

Direct calculation of the linear thermal expansion coefficients of MoS2 via symmetry-preserving deformations

Chee Kwan Gan, Yu Yang Fredrik Liu

Using density-functional perturbation theory and the Grüneisen formalism, we directly calculate the linear thermal expansion coefficients (TECs) of a hexagonal bulk system MoS…