| Neural network-based pseudopotential: development of a transferable local pseudopotential J Woo, H Kim, WY Kim Physical Chemistry Chemical Physics 24 (34), 20094-20103, 2022 | 12 | 2022 |
| ACE-Molecule: An open-source real-space quantum chemistry package S Kang, J Woo, J Kim, H Kim, Y Kim, J Lim, S Choi, WY Kim The Journal of Chemical Physics 152 (12), 2020 | 11 | 2020 |
| Diffusion-based generative AI for exploring transition states from 2D molecular graphs S Kim, J Woo, WY Kim Nature Communications 15 (1), 341, 2024 | 9 | 2024 |
| System-specific separable basis based on tucker decomposition: Application to density functional calculations J Woo, WY Kim, S Choi Journal of chemical theory and computation 18 (5), 2875-2884, 2022 | 6 | 2022 |
| Dynamic Precision Approach for Accelerating Large-Scale Eigenvalue Solvers in Electronic Structure Calculations on Graphics Processing Units J Woo, S Kim, WY Kim Journal of Chemical Theory and Computation 19 (5), 1457-1465, 2023 | 3 | 2023 |
| GeoTMI: predicting quantum chemical property with easy-to-obtain geometry via positional denoising H Kim, J Woo, S Kim, S Moon, JH Kim, WY Kim Advances in Neural Information Processing Systems 36, 2024 | 2 | 2024 |
| Gaussian-Approximated Poisson Preconditioner for Iterative Diagonalization in Real-Space Density Functional Theory J Woo, S Kim, WY Kim The Journal of Physical Chemistry A 127 (17), 3883-3893, 2023 | 2 | 2023 |
| Efficient Shift-and-Invert Preconditioning for Multi-GPU Accelerated Density Functional Calculations J Woo, W Youn Kim, S Choi Journal of Chemical Theory and Computation, 2024 | | 2024 |
| A 2D Graph-Based Generative Approach For Exploring Transition States Using Diffusion Model S Kim, J Woo, WY Kim arXiv e-prints, arXiv: 2304.12233, 2023 | | 2023 |
| Predicting quantum chemical property with easy-to-obtain geometry via positional denoising. H Kim, J Woo, S Kim, S Moon, JH Kim, WY Kim CoRR, 2023 | | 2023 |
Albert EinsteinInstitute of Advanced Studies, Princeton
Albert EinsteinInstitute of Advanced Studies, Princeton
Richard FeynmanCalifornia Institute of Technology
Niels BohrUniversity of Copenhagen
Erwin SchrodingerDublin Institute for Advanced Studies
