| Understanding and reducing errors in density functional calculations MC Kim, E Sim, K Burke Physical review letters 111 (7), 073003, 2013 | 353 | 2013 |
| Ultrathin zirconium disulfide nanodiscs J Jang, S Jeong, J Seo, MC Kim, E Sim, Y Oh, S Nam, B Park, J Cheon Journal of the American Chemical Society 133 (20), 7636-7639, 2011 | 161 | 2011 |
| Composition‐Dependent Hot Carrier Relaxation Dynamics in Cesium Lead Halide (CsPbX3, X=Br and I) Perovskite Nanocrystals H Chung, SI Jung, HJ Kim, W Cha, E Sim, D Kim, WK Koh, J Kim Angewandte Chemie 129 (15), 4224-4228, 2017 | 153 | 2017 |
| Communication: Avoiding unbound anions in density functional calculations MC Kim, E Sim, K Burke The Journal of chemical physics 134 (17), 2011 | 127 | 2011 |
| Long-time quantum simulation of the primary charge separation in bacterial photosynthesis. N Makri, E Sim, DE Makarov, M Topaler Proceedings of the National Academy of Sciences 93 (9), 3926-3931, 1996 | 126 | 1996 |
| Filtered propagator functional for iterative dynamics of quantum dissipative systems E Sim, N Makri Computer physics communications 99 (2-3), 335-354, 1997 | 121 | 1997 |
| The importance of being inconsistent A Wasserman, J Nafziger, K Jiang, MC Kim, E Sim, K Burke Annual review of physical chemistry 68, 555-581, 2017 | 118 | 2017 |
| Ions in solution: Density corrected density functional theory (DC-DFT) MC Kim, E Sim, K Burke The Journal of chemical physics 140 (18), 2014 | 116 | 2014 |
| Path integral simulation of charge transfer dynamics in photosynthetic reaction centers E Sim, N Makri The Journal of Physical Chemistry B 101 (27), 5446-5458, 1997 | 109 | 1997 |
| Improved DFT potential energy surfaces via improved densities MC Kim, H Park, S Son, E Sim, K Burke The journal of physical chemistry letters 6 (19), 3802-3807, 2015 | 102 | 2015 |
| Quantifying density errors in DFT E Sim, S Song, K Burke The journal of physical chemistry letters 9 (22), 6385-6392, 2018 | 94 | 2018 |
| Quantum dynamics for a system coupled to slow baths: On-the-fly filtered propagator method E Sim The Journal of Chemical Physics 115 (10), 4450-4456, 2001 | 93 | 2001 |
| Benchmarks and reliable DFT results for spin gaps of small ligand Fe (II) complexes S Song, MC Kim, E Sim, A Benali, O Heinonen, K Burke Journal of chemical theory and computation 14 (5), 2304-2311, 2018 | 81 | 2018 |
| Reversible transformation of helical coils and straight rods in cylindrical assembly of elliptical macrocycles JK Kim, E Lee, MC Kim, E Sim, M Lee Journal of the American Chemical Society 131 (49), 17768-17770, 2009 | 81 | 2009 |
| Tensor propagator with weight-selected paths for quantum dissipative dynamics with long-memory kernels E Sim, N Makri Chemical physics letters 249 (3-4), 224-230, 1996 | 79 | 1996 |
| Density functional analysis: The theory of density-corrected DFT S Vuckovic, S Song, J Kozlowski, E Sim, K Burke Journal of chemical theory and computation 15 (12), 6636-6646, 2019 | 78 | 2019 |
| Biased helical folding of chiral oligoindole foldamers VR Naidu, MC Kim, J Suk, HJ Kim, M Lee, E Sim, KS Jeong Organic Letters 10 (23), 5373-5376, 2008 | 76 | 2008 |
| Quantum rate constants from short-time dynamics: an analytic continuation approach E Sim, G Krilov, BJ Berne The Journal of Physical Chemistry A 105 (12), 2824-2833, 2001 | 62 | 2001 |
| Identification of droplet-flow-induced electric energy on electrolyte–insulator–semiconductor structure J Park, S Song, YJ Yang, SH Kwon, E Sim, YS Kim Journal of the American Chemical Society 139 (32), 10968-10971, 2017 | 61 | 2017 |
| Quantum time correlation functions from complex time Monte Carlo simulations: A maximum entropy approach G Krilov, E Sim, BJ Berne The Journal of Chemical Physics 114 (3), 1075-1088, 2001 | 61 | 2001 |
Kieron BurkeUC Irvine chemistry and physicsVerified email at uci.edu
