| Report on the sixth blind test of organic crystal structure prediction methods AM Reilly, RI Cooper, CS Adjiman, S Bhattacharya, AD Boese, ... Acta Crystallographica Section B: Structural Science, Crystal Engineering …, 2016 | 594 | 2016 |
| GAtor: a first-principles genetic algorithm for molecular crystal structure prediction F Curtis, X Li, T Rose, A Vazquez-Mayagoitia, S Bhattacharya, ... Journal of chemical theory and computation 14 (4), 2246-2264, 2018 | 121 | 2018 |
| Genarris: Random generation of molecular crystal structures and fast screening with a Harris approximation X Li, FS Curtis, T Rose, C Schober, A Vazquez-Mayagoitia, K Reuter, ... The Journal of Chemical Physics 148 (24), 2018 | 25 | 2018 |
| Evolutionary niching in the GAtor genetic algorithm for molecular crystal structure prediction F Curtis, T Rose, N Marom Faraday discussions 211, 61-77, 2018 | 24 | 2018 |
| Effect of packing motifs on the energy ranking and electronic properties of putative crystal structures of tricyano-1, 4-dithiino [c]-isothiazole F Curtis, X Wang, N Marom Acta Crystallographica Section B: Structural Science, Crystal Engineering …, 2016 | 21 | 2016 |
| This article is licensed under a Creative Commons Attribution 3.0 Unported Licence AM Reilly, RI Cooper, CS Adjiman, S Bhattacharya, AD Boese, ... P. Singh, IJ Sugden, K. Szalewicz, CR Taylor, A. Tkatchenko, ME Tuckerman, F …, 2016 | 7 | 2016 |
| Structure Prediction of Molecular Crystals from First Principles with the GAtor Genetic Algorithm Package F Curtis Carnegie Mellon University, 2018 | | 2018 |
| Electronic Structure-Based Discovery of Hybrid Photovoltaic Materials on Next-Generation HPC Platforms TJ Williams, R Balakrishnan, V Blum, WP Huhn, C Liu, D Mitzi, Y Kanai, ... Argonne National Lab.(ANL), Argonne, IL (United States), 2017 | | 2017 |
| Genarris: Parallelized Configuration Space Screening of Molecular Crystals Aided by a Harris Approximation X Li, F Curtis, C Schober, A Vazquez-Mayagoitia, H Oberhofer, N Marom APS March Meeting Abstracts 2017, L1. 010, 2017 | | 2017 |
| Reconstructing Dark Matter Halos in Galaxy Groups Using Weak Gravitational Lensing FS Curtis Reed College, 2012 | | 2012 |
| Evolutionary Niching in the GAtor Genetic Algorithm for Molecular CSP T Rose, F Curtis, N Marom | | |
