Spin–phonon couplings in transition metal complexes with slow magnetic relaxation DH Moseley, SE Stavretis, K Thirunavukkuarasu, M Ozerov, Y Cheng, ...
Nature communications 9 (1), 2572, 2018
112 2018 Evolution of amorphous carbon across densities: An inferential study B Bhattarai, A Pandey, DA Drabold
Carbon 131, 168-174, 2018
71 2018 Inversion of diffraction data for amorphous materials A Pandey, P Biswas, DA Drabold
Scientific Reports 6 (1), 33731, 2016
71 2016 Machine learning based surrogate modeling approach for mapping crystal deformation in three dimensions A Pandey, R Pokharel
Scripta Materialia 193, 1-5, 2021
56 2021 Force-enhanced atomic refinement: Structural modeling with interatomic forces in a reverse Monte Carlo approach applied to amorphous Si and A Pandey, P Biswas, DA Drabold
Physical Review B 92 (15), 155205, 2015
54 2015 Inelastic neutron scattering evidence for anomalous H–H distances in metal hydrides A Borgschulte, J Terreni, E Billeter, L Daemen, Y Cheng, A Pandey, ...
Proceedings of the National Academy of Sciences 117 (8), 4021-4026, 2020
36 2020 The effect of porosity and microcracking on the thermomechanical properties of cordierite A Shyam, G Bruno, TR Watkins, A Pandey, E Lara-Curzio, CM Parish, ...
Journal of the European Ceramic Society 35 (16), 4557-4566, 2015
34 2015 Realistic inversion of diffraction data for an amorphous solid: The case of amorphous silicon A Pandey, P Biswas, B Bhattarai, DA Drabold
Physical Review B 94 (23), 235208, 2016
33 2016 Electrical activity of boron and phosphorus in hydrogenated amorphous silicon A Pandey, B Cai, N Podraza, DA Drabold
Physical Review Applied 2 (5), 054005, 2014
22 2014 Physics-informed data-driven surrogate modeling for full-field 3D microstructure and micromechanical field evolution of polycrystalline materials R Pokharel, A Pandey, A Scheinker
JOM 73 (11), 3371-3382, 2021
13 2021 Machine learning enabled surrogate crystal plasticity model for spatially resolved 3d orientation evolution under uniaxial tension A Pandey, R Pokharel
arXiv preprint arXiv:2005.00951, 2020
13 2020 Density functional theory model of amorphous zinc oxide (a-ZnO) and a-X0. 375Z0. 625O (X= Al, Ga and In) A Pandey, H Scherich, DA Drabold
Journal of Non-Crystalline Solids 455, 98-101, 2017
12 2017 Exposing Key Vibrational Contributions to Properties of Organic Molecular Solids with High Signal, Low Frequency Neutron Spectroscopy and Ab Initio Simulations A Pandey, A Sedova, LL Daemen, Y Cheng, AJ Ramirez-Cuesta
Crystal Growth & Design 18 (9), 4815-4821, 2018
6 2018 Molecular Dynamics Study of Diffusion of Different Inert Gases Like Neon and Argon in Water at Different Temperatures HB Moktan, A Panday, NP Adhikari
International Journal of Modern Physics B 26 (03), 1250016, 2012
6 2012 Machine learning interatomic potential for high-throughput screening of high-entropy alloys A Pandey, J Gigax, R Pokharel
JOM 74 (8), 2908-2920, 2022
5 2022 Theoretical study of alkali-metal hydrides at high pressures: a case of NaH supported by inelastic neutron scattering (INS) experiments at 1 and 2 GPa A Pandey, J Zhang, Y Cheng, L Daemen, AJ Ramirez-Cuesta
The Journal of Physical Chemistry A 123 (46), 10079-10085, 2019
2 2019 Machine learning interatomic potential for high throughput screening and optimization of high-entropy alloys A Pandey, J Gigax, R Pokharel
arXiv preprint arXiv:2201.08906, 2022
1 2022 Periodic DFT calculations of vibrational and molecular dynamics on large organic molecular systems using olcf computers A Sedova, A Pandey, MD Smith
1 2018 Best of Both Worlds: Enforcing Detailed Balance in Machine Learning Models of Transition Rates AA Talapatra, A Pandey, MS Wilson, YW Li, G Pilania, BP Uberuaga, ...
arXiv preprint arXiv:2409.12284, 2024
2024 Capabilities and Advantages of the GasModels Package S Srinivasan, K Sundar, SKK Hari, A Zlotnik, A Pandey, M Ewers, D Fobes, ...
PSIG Annual Meeting, PSIG-2414, 2024
2024 
David A. DraboldOhio UniversityEmail verificata su ohio.edu