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Physical Review Materials|June 5, 2023
Fast and accurate prediction of material properties with three-body tight-binding model for the periodic tableKevin F Garrity, Kamal ChoudharyScientific Data|April 14, 2021
Database of Wannier tight-binding Hamiltonians using high-throughput density functional theoryKevin F Garrity, Kamal ChoudharyScientific Reports|June 14, 2019
High-throughput Discovery of Topologically Non-trivial Materials using Spin-orbit SpillageKamal Choudhary, Kevin F Garrity, Francesca TavazzaJournal of Physics. Condensed Matter : an Institute of Physics Journal|June 27, 2020
Data-driven discovery of 3D and 2D thermoelectric materialsKamal Choudhary, Kevin F Garrity, Francesca TavazzaNano Letters|January 30, 2023
High-Throughput DFT-Based Discovery of Next Generation Two-Dimensional (2D) SuperconductorsDaniel Wines, Kamal Choudhary, Adam J Biacchi, et al.Npj Computational Materials|November 20, 2024
High-throughput Density Functional Perturbation Theory and Machine Learning Predictions of Infrared, Piezoelectric and Dielectric ResponsesKamal Choudhary, Kevin F Garrity, Vinit Sharma, et al.Scientific Data|February 12, 2021
Computational scanning tunneling microscope image databaseKamal Choudhary, Kevin F Garrity, Charles Camp, et al.Physical Review. B|April 16, 2019
High-throughput first principles search for new ferroelectricsKevin F GarrityPhysical Review. B|November 26, 2016
First principles search for <i>n</i>-type oxide, nitride, and sulfide thermoelectricsKevin F GarrityPhysical Review Letters|August 29, 2014
Chern insulators from heavy atoms on magnetic substratesKevin F Garrity, David VanderbiltPageof 7