| Dielectric constant of liquid water determined with neural network quantum molecular dynamics A Krishnamoorthy, K Nomura, N Baradwaj, K Shimamura, P Rajak, ... Physical Review Letters 126 (21), 216403, 2021 | 38 | 2021 |
| Evolutionary multi-objective optimization and Pareto-frontal uncertainty quantification of interatomic forcefields for thermal conductivity simulations A Krishnamoorthy, A Mishra, N Grabar, N Baradwaj, RK Kalia, A Nakano, ... Computer Physics Communications 254, 107337, 2020 | 15 | 2020 |
| Hydrogen bonding in liquid ammonia A Krishnamoorthy, K Nomura, N Baradwaj, K Shimamura, R Ma, ... The Journal of Physical Chemistry Letters 13 (30), 7051-7057, 2022 | 10 | 2022 |
| Lattice thermal transport in two-dimensional alloys and fractal heterostructures A Krishnamoorthy, N Baradwaj, A Nakano, RK Kalia, P Vashishta Scientific Reports 11 (1), 1656, 2021 | 9 | 2021 |
| Neural Network Quantum Molecular Dynamics, Intermediate Range Order in GeSe2, and Neutron Scattering Experiments P Rajak, N Baradwaj, K Nomura, A Krishnamoorthy, JP Rino, ... The Journal of Physical Chemistry Letters 12 (25), 6020-6028, 2021 | 7 | 2021 |
| Tailoring the Angular Mismatch in MoS2 Homobilayers through Deformation Fields K Burns, AMZ Tan, JA Hachtel, A Aditya, N Baradwaj, A Mishra, T Linker, ... Small 19 (29), 2300098, 2023 | 4 | 2023 |
| Wrinkles, Ridges, Miura-Ori, and Moiré Patterns in MoSe2 Using Neural Networks A Aditya, A Mishra, N Baradwaj, K Nomura, A Nakano, P Vashishta, ... The Journal of Physical Chemistry Letters 14 (7), 1732-1739, 2023 | 4 | 2023 |
| Asymmetric nanoparticle oxidation observed in-situ by the evolution of diffraction contrast AR Poerwoprajitno, N Baradwaj, MK Singh, CB Carter, DL Huber, R Kalia, ... Journal of Physics: Materials 6 (4), 045013, 2023 | 3 | 2023 |
| Materials genome software framework: scalable parallel simulation, virtual reality visualization and machine learning A Mishra, N Baradwaj, L Bassman, BK Horton, S Tiwari, S Hong, ... Proceedings of the International Conference on Scientific Computing (CSC …, 2019 | 3 | 2019 |
| Alkali hydroxide (LiOH, NaOH, KOH) in water: Structural and vibrational properties, including neutron scattering results R Ma, N Baradwaj, K Nomura, A Krishnamoorthy, RK Kalia, A Nakano, ... The Journal of Chemical Physics 160 (13), 2024 | 2 | 2024 |
| Probing phonon focusing, thermomechanical behavior, and moiré patterns in van der Waals architectures using surface acoustic waves N Baradwaj, A Aditya, A Mishra, K Burns, E Lang, JA Hachtel, K Hattar, ... npj Computational Materials 10 (1), 137, 2024 | 1 | 2024 |
| Asymmetric Nanoparticle Oxidation Observed In-Situ by the Evolution of Diffraction Contrast AR Poerwoprajitno, N Baradwaj, MK Singh, C Barry Carter, DL Huber, ... Microscopy and Microanalysis 30 (Supplement_1), ozae044. 826, 2024 | | 2024 |
| Supercritical water at ten densities from 0.1 gr/cc to 1.0 gr/cc at 1,000 K using Quantum Molecular Dynamics simulations N Baradwaj, K Nomurra, A Nakano, R Kalia, P Vashishta Bulletin of the American Physical Society, 2024 | | 2024 |
| Carbon Sequestration Reaction Using Magnesium Silicate–A Quantum Molecular Dynamics Study N Baradwaj, K Nomurra, A Nakano, R Kalia, P Vashishta Bulletin of the American Physical Society, 2024 | | 2024 |
| Probing Phonon Focusing, Thermomechanical Behavior, and Moiré Patterns in van der Waals Architectures Using Surface Acoustic Waves R Kalia, N Baradwaj, A Aditya, A Mishra, K Burns, E Lang, J Hachtel, ... | | 2023 |
| Kibble–Zurek scaling of nonequilibrium phase transition in barium titanate N Baradwaj, A Krishnamoorthy, K Nomura, A Nakano, RK Kalia, ... Applied Physics Letters 123 (25), 2023 | | 2023 |
| Kibble-Zurek Scaling Study of Phase Transition in Barium Titanate (BaTiO3) N Baradwaj, A Krishnamoorthy, KI Nomurra, A Nakano, R Kalia, ... APS March Meeting Abstracts 2023, D60. 009, 2023 | | 2023 |
| Structure and Dielectric Properties of Water and Aqueous Solutions Using Neural Network Quantum Molecular Dynamics R Ma, A Krishnamurthy, N Baradwaj, KI Nomura, K Shimamura, P Rajak, ... APS March Meeting Abstracts 2023, K62. 006, 2023 | | 2023 |
| Probing Thermomechanical Properties of Two-dimensional van der Waals Architectures Using Surface Acoustic Waves A Aditya, N Baradwaj, A Mishra, KI Nomura, A Nakano, P Vashishta, ... APS March Meeting Abstracts 2023, K62. 003, 2023 | | 2023 |
| Structure and Dynamics of Supercritical Water Determined With Neural Network Quantum Molecular Dynamics N Baradwaj, A Krishnamoorthy, KI Nomura, K Shimamura, R Kalia, ... APS March Meeting Abstracts 2022, G00. 283, 2022 | | 2022 |
