832 citations · 3.6k across the 65 of their papers we have counts for
8 papers · 1 filter
Identifying the fingerprints of topological states by tuning magnetoresistance in a semimetal: the case of topological half-Heusler Pt1-xAuxLuSb
Shouvik Chatterjee, Felipe Crasto de Lima, John A. Logan +18
Topological materials often exhibit remarkably linear, non-saturating magnetoresistance (LMR), which is both of scientific and technological importance. However, the role of topolo…
Exploring In(SeTe) alloys as photovoltaic materials
Wei Li, Xuefen Cai, Nicholas Valdes +4
InSe in the three-dimensional (3D) hexagonal crystal structure with space group (-InSe) has a direct band gap of 1.8 eV and high absorption coeffici…
Electronic correlations in the semiconducting half-Heusler compound FeVSb
Estiaque H. Shourov, Patrick J. Strohbeen, Dongxue Du +8
Electronic correlations are crucial to the low energy physics of metallic systems with localized and states; however, their effect on band insulators and semiconductors is…
Electronic Structure and Small Hole Polarons in YTiO3
Jin Yue, Nicholas F. Quackenbush, Iflah Laraib +10
As a prototypical Mott insulator with ferromagnetic ordering, YTiO3 (YTO) is of great interest in the study of strong electron correlation effects and orbital ordering. Here we rep…
Predicting band gaps and band-edge positions of oxide perovskites using DFT and machine learning
Wei Li, Zigeng Wang, Xia Xiao +4
Density functional theory within the local or semilocal density approximations (DFT-LDA/GGA) has become a workhorse in electronic structure theory of solids, being extremely fast a…
Trivial to nontrivial topology transition in rare-earth pnictides with epitaxial strain
Shoaib Khalid, Anderson Janotti
The combination of magneto-transport and topological properties has brought great attention to rare-earth mono-pnictides semimetals. For some of them, like LaSb, it is unclear whet…