| QMCPACK: an open source ab initio quantum Monte Carlo package for the electronic structure of atoms, molecules and solids J Kim, AD Baczewski, TD Beaudet, A Benali, MC Bennett, MA Berrill, ... Journal of Physics: Condensed Matter 30 (19), 195901, 2018 | 306 | 2018 |
| Molecular to atomic phase transition in hydrogen under high pressure J McMinis, RC Clay III, D Lee, MA Morales Physical Review Letters 114 (10), 105305, 2015 | 172 | 2015 |
| Multi-Determinant Wave-functions in Quantum Monte Carlo MA Morales, J McMinis, BK Clark, J Kim, GE Scuseria Journal of Chemical Theory and Computation, 2012 | 153 | 2012 |
| Benchmarking exchange-correlation functionals for hydrogen at high pressures using quantum Monte Carlo RC Clay III, J Mcminis, JM McMahon, C Pierleoni, DM Ceperley, ... Physical Review B 89 (18), 184106, 2014 | 101 | 2014 |
| Hybrid algorithms in quantum Monte Carlo J Kim, KP Esler, J McMinis, MA Morales, BK Clark, L Shulenburger, ... Journal of Physics: Conference Series 402 (1), 012008, 2012 | 97 | 2012 |
| Computing the energy of a water molecule using multideterminants: A simple, efficient algorithm BK Clark, MA Morales, J McMinis, J Kim, GE Scuseria The Journal of chemical physics 135 (24), 2011 | 93 | 2011 |
| Momentum distribution of the homogeneous electron gas M Holzmann, B Bernu, C Pierleoni, J McMinis, DM Ceperley, V Olevano, ... Physical review letters 107 (11), 110402, 2011 | 92 | 2011 |
| Momentum distribution and renormalization factor in sodium and the electron gas S Huotari, JA Soininen, T Pylkkänen, K Hämäläinen, A Issolah, A Titov, ... Physical review letters 105 (8), 086403, 2010 | 91 | 2010 |
| Renyi Entropy of the Interacting Fermi Liquid J McMinis, NM Tubman Physical Review B 87, 081108, 2012 | 73 | 2012 |
| Quantum Monte Carlo benchmark of exchange-correlation functionals for bulk water MA Morales, JR Gergely, J McMinis, JM McMahon, J Kim, DM Ceperley Journal of Chemical Theory and Computation 10 (6), 2355-2362, 2014 | 49 | 2014 |
| Experimental study of mechanical properties and scratch resistance of ultra-thin diamond-like-carbon (DLC) coatings deposited on glass R Crombez, J McMinis, VS Veerasamy, W Shen Tribology International 44 (1), 55-62, 2011 | 41 | 2011 |
| Oscillating terms in the Renyi entropy of Fermi gases and liquids B Swingle, J McMinis, NM Tubman Physical Review B—Condensed Matter and Materials Physics 87 (23), 235112, 2013 | 30 | 2013 |
| QMCPACK simulation suite J Kim, K Esler, J McMinis, B Clark, J Gergely, S Chiesa, K Delaney, ... | 13* | |
| Renyi Entanglement Entropy of Molecules: Interaction Effects and Signatures of Bonding NM Tubman, J McMinis Arxiv preprint arXiv:1204.4731, 2012 | 12 | 2012 |
| Quantum monte carlo algorithms: making most of large-scale multi/many-core clusters J Kim, K Esler, J McMinis, DM Ceperley Proceedings of the 2010 Scientific Discovery through Advanced Computing …, 2010 | 10 | 2010 |
| Determination of the cross-sectional area of the indenter in nano-indentation tests J McMinis, R Crombez, E Montalvo, W Shen Physica B: Condensed Matter 391 (1), 118-123, 2007 | 10 | 2007 |
| BENCHMARK STUDIES USING QUANTUM MONTE CARLO: PRESSURE ESTIMATORS, ENERGY, AND ENTANGLEMENT J MCMINIS | 2* | |
| The transition to the metallic state in low density hydrogen J McMinis, MA Morales, DM Ceperley, J Kim The Journal of Chemical Physics 143 (19), 2015 | 1 | 2015 |
| Erratum to “Experimental study of mechanical properties and scratch resistance of ultra-thin diamond-like-carbon (DLC) coatings deposited on glass”[Tribol. Int. 44 (1)(2011) 55–62] R Crombez, J McMinis, VS Veerasamy, W Shen Tribology International 3 (44), 343-345, 2011 | 1 | 2011 |
| Quantum Monte Carlo estimation of the energetics and thermodynamics of water and ice DM Ceperley, J Gergely, B Clark, K Esler, J McMinis, J Kim ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 238, 2009 | | 2009 |
Miguel A MoralesFlatiron InstituteE-mailová adresa ověřena na: flatironinstitute.org
