activity
20192021
most citedAccurate electronic band gaps of two-dimensional materials from the local modified Becke-Johnson potential

47 citations · 47 across the 3 of their papers we have counts for

collaborators

5 papers

cond-mat.mtrl-sci2021

Electronic Structure and Epitaxy of CdTe Shells on InSb Nanowires

Ghada Badawy, Bomin Zhang, Tomáš Rauch +10

Indium antimonide (InSb) nanowires are used as building blocks for quantum devices because of their unique properties, i.e., strong spin-orbit interaction and large Landé g-factor.…

cond-mat.mes-hall2021

Mirror Chern numbers in the hybrid Wannier representation

Tomáš Rauch, Thomas Olsen, David Vanderbilt +1

The topology of electronic states in band insulators with mirror symmetry can be classified in two different ways. One is in terms of the mirror Chern number, an integer that count…

cond-mat.mtrl-sci2020

Gapless hinge states from adiabatic pumping of axion coupling

Thomas Olsen, Tomáš Rauch, David Vanderbilt +1

We demonstrate that chiral hinge modes naturally emerge in insulating crystals undergoing a slow cyclic evolution that changes the Chern-Simons axion angle by . This happen…

cond-mat.mes-hall202047 cited

Accurate electronic band gaps of two-dimensional materials from the local modified Becke-Johnson potential

Tomáš Rauch, Miguel A. L. Marques, Silvana Botti

The electronic band structures of two-dimensional materials are significantly different from those of their bulk counterparts, due to quantum confinement and strong modifications o…

cond-mat.mes-hall2019

Local modified Becke-Johnson exchange-correlation potential for interfaces, surfaces, and two-dimensional materials

Tomáš Rauch, Miguel A. L. Marques, Silvana Botti

The modified Becke-Johnson meta-GGA potential of density functional theory has been shown to be the best exchange-correlation potential to determine band gaps of crystalline solids…