| Tuneable structure and magnetic properties in Fe3− xVxGe alloys R Mahat, KC Shambhu, D Wines, F Ersan, S Regmi, U Karki, R White, ... Journal of Alloys and Compounds 830, 154403, 2020 | 31 | 2020 |
| Electronic properties of bare and functionalized two-dimensional (2D) tellurene structures D Wines, JA Kropp, G Chaney, F Ersan, C Ataca Physical Chemistry Chemical Physics 22 (12), 6727-6737, 2020 | 31 | 2020 |
| Positive and Negative Photoconductivity in Monolayer MoS2 as a Function of Physisorbed Oxygen JK Gustafson, D Wines, E Gulian, C Ataca, LM Hayden The Journal of Physical Chemistry C 125 (16), 8712-8718, 2021 | 26 | 2021 |
| A first-principles Quantum Monte Carlo study of two-dimensional (2D) GaSe D Wines, K Saritas, C Ataca The Journal of Chemical Physics 153 (15), 2020 | 25 | 2020 |
| Engineering the Electronic, Thermoelectric, and Excitonic Properties of Two-Dimensional Group-III Nitrides through Alloying for Optoelectronic Devices (B1–x Al x N, Al1–x Ga x … D Wines, F Ersan, C Ataca ACS Applied Materials & Interfaces 12 (41), 46416-46428, 2020 | 25 | 2020 |
| Influence of Cr-substitution on the structural, magnetic, electron transport, and mechanical properties of Fe3− xCrxGe Heusler alloys R Mahat, KC Shambhu, D Wines, S Regmi, U Karki, Z Li, F Ersan, JY Law, ... Journal of Magnetism and Magnetic Materials 521, 167398, 2021 | 23 | 2021 |
| High-throughput DFT-based discovery of next generation two-dimensional (2D) superconductors D Wines, K Choudhary, AJ Biacchi, KF Garrity, F Tavazza Nano letters 23 (3), 969-978, 2023 | 19 | 2023 |
| Systematic DFT+U and Quantum Monte Carlo Benchmark of Magnetic Two-Dimensional (2D) CrX3 (X = I, Br, Cl, F) D Wines, K Choudhary, F Tavazza The Journal of Physical Chemistry C 127 (2), 1176-1188, 2023 | 12 | 2023 |
| Inverse design of next-generation superconductors using data-driven deep generative models D Wines, T Xie, K Choudhary The Journal of Physical Chemistry Letters 14 (29), 6630-6638, 2023 | 11 | 2023 |
| Large scale benchmark of materials design methods K Choudhary, D Wines, K Li, KF Garrity, V Gupta, AH Romero, JT Krogel, ... arXiv preprint arXiv:2306.11688, 2023 | 10 | 2023 |
| A pathway toward high-throughput quantum Monte Carlo simulations for alloys: A case study of two-dimensional (2D) GaSxSe1− x D Wines, K Saritas, C Ataca The Journal of Chemical Physics 155 (19), 2021 | 8 | 2021 |
| Abnormal phase transition and band renormalization of guanidinium-based organic–inorganic hybrid perovskite H Li, D Wines, B Chen, K Yumigeta, YM Sayyad, J Kopaszek, S Yang, ... ACS Applied Materials & Interfaces 13 (37), 44964-44971, 2021 | 8 | 2021 |
| Intrinsic Ferromagnetism of Two-Dimensional (2D) MnO2 Revisited: A Many-Body Quantum Monte Carlo and DFT+U Study D Wines, K Saritas, C Ataca The Journal of Physical Chemistry C 126 (13), 5813-5821, 2022 | 7 | 2022 |
| A Quantum Monte Carlo Study of the Structural, Energetic, and Magnetic Properties of Two-Dimensional H and T Phase VSe2 D Wines, J Tiihonen, K Saritas, JT Krogel, C Ataca The Journal of Physical Chemistry Letters 14 (14), 3553-3560, 2023 | 5 | 2023 |
| Effect of V substitution on structural, magnetic, transport and mechanical properties of the half-metal-type Heusler alloy Co2FeGe R Mahat, S KC, D Wines, S Regmi, U KARKI, F Ersan, C Ataca, A Gupta, ... Bulletin of the American Physical Society 65, 2020 | 4 | 2020 |
| Recent progress in the JARVIS infrastructure for next-generation data-driven materials design D Wines, R Gurunathan, KF Garrity, B DeCost, AJ Biacchi, F Tavazza, ... Applied Physics Reviews 10 (4), 2023 | 3 | 2023 |
| Modeling Chemical Exfoliation of Non-van der Waals Chromium Sulfides by Machine Learning Interatomic Potentials and Monte Carlo Simulations A Ibrahim, D Wines, C Ataca The Journal of Physical Chemistry C 128 (3), 1267-1283, 2024 | 1 | 2024 |
| Neural network potentials for modeling nonstoichiometric materials: a case of Chromium Sulfides CrS A Ibrahim, D Wines, C Ataca arXiv preprint arXiv:2308.05163, 2023 | 1 | 2023 |
| Forward and Inverse design of high superconductors with DFT and deep learning D Wines, KF Garrity, T Xie, K Choudhary Workshop on''Machine Learning for Materials''ICLR 2023, 2023 | 1 | 2023 |
| Forward and inverse design of ambient and high pressure superconductors using DFT and deep learning D Wines, K Choudhary Bulletin of the American Physical Society, 2024 | | 2024 |
Can ATACAAssociate ProfessorVerified email at umbc.edu
