| A first-principles approach to finite temperature elastic constants Y Wang, JJ Wang, H Zhang, VR Manga, SL Shang, LQ Chen, ZK Liu Journal of Physics: Condensed Matter 22 (22), 225404, 2010 | 254 | 2010 |
| Interface between quantum-mechanical-based approaches, experiments, and CALPHAD methodology PEA Turchi, IA Abrikosov, B Burton, SG Fries, G Grimvall, L Kaufman, ... Calphad 31 (1), 4-27, 2007 | 143 | 2007 |
| Palladium-alloy membrane reactors for fuel reforming and hydrogen production: a review MA Habib, A Harale, S Paglieri, FS Alrashed, A Al-Sayoud, MV Rao, ... Energy & Fuels 35 (7), 5558-5593, 2021 | 76 | 2021 |
| Stress-induced anisotropic diffusion in alloys: Complex Si solute flow near a dislocation core in Ni T Garnier, VR Manga, DR Trinkle, M Nastar, P Bellon Physical Review B—Condensed Matter and Materials Physics 88 (13), 134108, 2013 | 58 | 2013 |
| First-principles calculations and thermodynamic modeling of the Al–Pt binary system DE Kim, VR Manga, SN Prins, ZK Liu Calphad 35 (1), 20-29, 2011 | 49 | 2011 |
| Interplay between structure and transport properties in molten salt mixtures of ZnCl2-NaCl-KCl: A molecular dynamics study VR Manga, N Swinteck, S Bringuier, P Lucas, P Deymier, K Muralidharan J. Chem. Phys. 144, 094501, 2016 | 37 | 2016 |
| Anomalous phonon stiffening associated with the (1 1 1) antiphase boundary in L12 Ni3Al VR Manga, SL Shang, WY Wang, Y Wang, J Liang, VH Crespi, ZK Liu Acta Materialia 82, 287-294, 2015 | 37 | 2015 |
| Structure of ZnCl2 Melt. Part II: Fragile-to-Strong Transition in a Tetrahedral Liquid P Lucas, GJ Coleman, M Venkateswara Rao, AN Edwards, ... The Journal of Physical Chemistry B 121 (49), 11210-11218, 2017 | 34 | 2017 |
| Diffusion of Si impurities in Ni under stress: A first-principles study T Garnier, VR Manga, P Bellon, DR Trinkle Physical Review B 90 (2), 024306, 2014 | 34 | 2014 |
| Structure of ZnCl2 Melt Part I: Raman Spectroscopy Analysis Driven by Ab Initio Methods A Abduljabar Qassem, M Venkateswara Rao, AN Edwards, AD Pierre, ... J. Phys. Chem. B 120 (17), 4174, 2016 | 32* | 2016 |
| Molecular dynamics simulations and thermodynamic modeling of NaCl–KCl–ZnCl2 ternary system VR Manga, S Bringuier, J Paul, S Jayaraman, P Lucas, P Deymier, ... Calphad 46, 176-183, 2014 | 28 | 2014 |
| Magnetic perturbation and associated energies of the antiphase boundaries in ordered Ni3Al VR Manga, JE Saal, Y Wang, VH Crespi, ZK Liu Journal of Applied Physics 108 (10), 2010 | 28 | 2010 |
| Effect of Mg, Ca, and Zn on stability of LiBH4 through computational thermodynamics SH Lee, VR Manga, ZK Liu International journal of hydrogen energy 35 (13), 6812-6821, 2010 | 27 | 2010 |
| Defects in boron carbide: First-principles calculations and CALPHAD modeling A Saengdeejing, JE Saal, VR Manga, ZK Liu Acta materialia 60 (20), 7207-7215, 2012 | 23 | 2012 |
| Defect Chemistry and Phase Equilibria of (La1-xCax) FeO3-δ Thermodynamic Modeling SH Lee, VR Manga, MF Carolan, ZK Liu Journal of the Electrochemical Society 160 (10), F1103, 2013 | 20 | 2013 |
| The influence of the solid electrolyte on the impedance of hydrogen oxidation at patterned Ni electrodes MV Rao, J Fleig, M Zinkevich, F Aldinger Solid State Ionics 181 (25-26), 1170-1177, 2010 | 19 | 2010 |
| Thermochemical model on the carbothermal reduction of oxides during spark plasma sintering of zirconium diboride D Pham, JH Dycus, JM LeBeau, VR Manga, K Muralidharan, EL Corral Journal of the American Ceramic Society 102 (2), 757-767, 2019 | 13 | 2019 |
| Ab initio molecular dynamics simulation of self-diffusion in Al–Si binary melts VR Manga, DR Poirier Modelling and Simulation in Materials Science and Engineering 26 (6), 065006, 2018 | 13 | 2018 |
| Grain boundary dynamics of SiC bicrystals under shear deformation S Bringuier, VR Manga, K Runge, P Deymier, K Muralidharan Materials Science and Engineering: A 634, 161-166, 2015 | 13 | 2015 |
| Processing Low‐Oxide ZrB2 Ceramics with High Strength Using Boron Carbide and Spark Plasma Sintering D Pham, JH Dycus, JM LeBeau, VR Manga, K Muralidharan, EL Corral Journal of the American Ceramic Society 99 (8), 2585-2592, 2016 | 12 | 2016 |
