| Electronic and bonding analysis of hardness in pyrite-type transition-metal pernitrides ZTY Liu, D Gall, SV Khare Physical review B 90 (13), 134102, 2014 | 130 | 2014 |
| Structural, mechanical and electronic properties of 3d transition metal nitrides in cubic zincblende, rocksalt and cesium chloride structures: a first-principles investigation ZTY Liu, X Zhou, SV Khare, D Gall Journal of Physics: Condensed Matter 26 (2), 025404, 2013 | 121 | 2013 |
| First-principles investigation of the structural, mechanical and electronic properties of the NbO-structured 3d, 4d and 5d transition metal nitrides ZTY Liu, X Zhou, D Gall, SV Khare Computational materials science 84, 365-373, 2014 | 95 | 2014 |
| Electronic and optical properties of vanadium oxides from first principles NJ Szymanski, ZTY Liu, T Alderson, NJ Podraza, P Sarin, SV Khare Computational Materials Science 146, 310-318, 2018 | 64 | 2018 |
| First-principles phase diagram calculations for the rocksalt-structure quasibinary systems TiN–ZrN, TiN–HfN and ZrN–HfN ZTY Liu, BP Burton, SV Khare, D Gall Journal of Physics: Condensed Matter 29 (3), 035401, 2016 | 55 | 2016 |
| Pressure-induced transition in the multiferroic spinel I Efthimiopoulos, ZTY Liu, SV Khare, P Sarin, T Lochbiler, V Tsurkan, ... Physical Review B 92 (6), 064108, 2015 | 50 | 2015 |
| First-principles study of mechanical and magnetic properties of transition metal (M) nitrides in the cubic M4N structure V Adhikari, ZTY Liu, NJ Szymanski, I Khatri, D Gall, P Sarin, SV Khare Journal of Physics and Chemistry of Solids 120, 197-206, 2018 | 46 | 2018 |
| Thermal equation of state of silicon carbide Y Wang, ZTY Liu, SV Khare, SA Collins, J Zhang, L Wang, Y Zhao Applied Physics Letters 108 (6), 2016 | 45 | 2016 |
| Universal link of magnetic exchange and structural behavior under pressure in chromium spinels I Efthimiopoulos, I Khatri, ZTY Liu, SV Khare, P Sarin, V Tsurkan, A Loidl, ... Physical Review B 97 (18), 184435, 2018 | 26 | 2018 |
| Structural transition in the magnetoelectric spinel under pressure I Efthimiopoulos, ZTY Liu, SV Khare, P Sarin, V Tsurkan, A Loidl, D Popov, ... Physical Review B 93 (17), 174103, 2016 | 21 | 2016 |
| Pressure-induced phase transitions in the spinel I Efthimiopoulos, ZTY Liu, M Kucway, SV Khare, P Sarin, V Tsurkan, ... Physical Review B 94 (17), 174106, 2016 | 20 | 2016 |
| First-principles phase diagram calculations for the carbonate quasibinary systems CaCO3-ZnCO3, CdCO3-ZnCO3, CaCO3-CdCO3 and MgCO3-ZnCO3 ZTY Liu, BP Burton, SV Khare, P Sarin Chemical Geology 443, 137-145, 2016 | 18 | 2016 |
| Transparency enhancement for SrVO3 by SrTiO3 mixing: A first-principles study ZTY Liu, NJ Podraza, SV Khare, P Sarin Computational Materials Science 144, 139-146, 2018 | 17 | 2018 |
| Diffusion in CdS of Cd and S vacancies and Cu, Cd, Cl, S and Te interstitials studied with first-principles computations JL Roehl, ZTY Liu, SV Khare Materials Research Express 1 (2), 025904, 2014 | 11 | 2014 |
| pyvasp-workflow, a simple yet flexible programmatic workflow of describing, submitting and analyzing VASP jobs ZTY Liu | 3 | 2016 |
| Transition Metal Nitrides and Their Solid Solutions: A First-Principles Approach with Cluster Expansion Computational Predictive Models Z Liu University of Toledo, 2017 | 2 | 2017 |
| Universal Connection of magnetic exchange and structural behavior under pressure in chromium spinels. I Efthimiopoulos, I Khatri, T Liu, S Khare, P Sarin, V Tsurkan, A Loidl, ... Bulletin of the American Physical Society 63, 2018 | | 2018 |
Pankaj SarinOklahoma State UniversityVerified email at okstate.edu
