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We study thermoelectric transport at low temperatures in correlated Kondo insulators, motivated by the recent observation of a high thermoelectric figure of merit(ZT) in $FeSb_2$ at $T sim 10 K$. Even at room temperature, correlations have the potential to lead to high ZT, as in $YbAl_3$, one of the most widely used thermoelectric metals. At low temperature correlation effects are especially worthy of study because fixed band structures are unlikely to give rise to the very small energy gaps $E_g sim 5 kT$ necessary for a weakly correlated material to function efficiently at low temperature. We explore the possibility of improving the thermoelectric properties of correlated Kondo insulators through tuning of crystal field and spin-orbit coupling and present a framework to design more efficient low-temperature thermoelectrics based on our results.
We have systematically investigated substrate-strain effects on the electronic structures of two representative Sr-iridates, a correlated-insulator Sr$_2$IrO$_4$ and a metal SrIrO$_3$. Optical conductivities obtained by the emph{ab initio} electronic
Van der Waals (VdW) materials have opened new directions in the study of low dimensional magnetism. A largely unexplored arena is the intrinsic tuning of VdW magnets toward new ground-states. The chromium trihalides provided the first such example wi
The magnetic properties of two-dimensional VI3 bilayer are the focus of our first-principles analysis, highlighting the role of trigonal crystal-field effects and carried out in comparison with the CrI3 prototypical case, where the effects are absent
Huge deformations of the crystal lattice can be achieved in materials with inherent structural instability by epitaxial straining. By coherent growth on seven different substrates the in-plane lattice constants of 50 nm thick Fe70Pd30 films are conti
Synergic effect of electronic correlation and spin-orbit coupling is an emerging topic in topological materials. Central to this rapidly developing area are the prototypes of strongly correlated heavy-fermion systems. Recently, some Ce-based compound