| Heat-bath configuration interaction: An efficient selected configuration interaction algorithm inspired by heat-bath sampling AA Holmes, NM Tubman, CJ Umrigar Journal of chemical theory and computation 12 (8), 3674-3680, 2016 | 469 | 2016 |
| Semistochastic heat-bath configuration interaction method: Selected configuration interaction with semistochastic perturbation theory S Sharma, AA Holmes, G Jeanmairet, A Alavi, CJ Umrigar Journal of chemical theory and computation 13 (4), 1595-1604, 2017 | 355 | 2017 |
| Semistochastic projector monte carlo method FR Petruzielo, AA Holmes, HJ Changlani, MP Nightingale, CJ Umrigar Physical review letters 109 (23), 230201, 2012 | 204 | 2012 |
| Cheap and near exact CASSCF with large active spaces JET Smith, B Mussard, AA Holmes, S Sharma Journal of chemical theory and computation 13 (11), 5468-5478, 2017 | 198 | 2017 |
| Excited states using semistochastic heat-bath configuration interaction AA Holmes, CJ Umrigar, S Sharma The Journal of Chemical Physics 147 (16), 2017 | 167 | 2017 |
| Fast semistochastic heat-bath configuration interaction J Li, M Otten, AA Holmes, S Sharma, CJ Umrigar The Journal of chemical physics 149 (21), 2018 | 161 | 2018 |
| Excited states of methylene, polyenes, and ozone from heat-bath configuration interaction AD Chien, AA Holmes, M Otten, CJ Umrigar, S Sharma, PM Zimmerman The Journal of Physical Chemistry A 122 (10), 2714-2722, 2018 | 115 | 2018 |
| Efficient heat-bath sampling in Fock space AA Holmes, HJ Changlani, CJ Umrigar Journal of Chemical Theory and Computation 12 (4), 1561-1571, 2016 | 107 | 2016 |
| Accurate many-body electronic structure near the basis set limit: Application to the chromium dimer J Li, Y Yao, AA Holmes, M Otten, Q Sun, S Sharma, CJ Umrigar Physical Review Research 2 (1), 012015, 2020 | 54 | 2020 |
| Direct determination of optimal real-space orbitals for correlated electronic structure of molecules EF Valeev, RJ Harrison, AA Holmes, CC Peterson, DA Penchoff Journal of Chemical Theory and Computation 19 (20), 7230-7241, 2023 | 4 | 2023 |
C. J. UmrigarCornell UniversityVerified email at cornell.edu