| A climbing image nudged elastic band method for finding saddle points and minimum energy paths G Henkelman, BP Uberuaga, H Jónsson The Journal of chemical physics 113 (22), 9901-9904, 2000 | 19724 | 2000 |
| Efficient annealing of radiation damage near grain boundaries via interstitial emission XM Bai, AF Voter, RG Hoagland, M Nastasi, BP Uberuaga Science 327 (5973), 1631-1634, 2010 | 1140 | 2010 |
| Radiation-induced amorphization resistance and radiation tolerance in structurally related oxides KE Sickafus, RW Grimes, JA Valdez, A Cleave, M Tang, M Ishimaru, ... Nature materials 6 (3), 217-223, 2007 | 614 | 2007 |
| Defect-interface interactions IJ Beyerlein, MJ Demkowicz, A Misra, BP Uberuaga Progress in Materials Science 74, 125-210, 2015 | 566 | 2015 |
| Radiation damage tolerant nanomaterials IJ Beyerlein, A Caro, MJ Demkowicz, NA Mara, A Misra, BP Uberuaga Materials today 16 (11), 443-449, 2013 | 560 | 2013 |
| Machine learning bandgaps of double perovskites G Pilania, A Mannodi-Kanakkithodi, BP Uberuaga, R Ramprasad, ... Scientific reports 6 (1), 19375, 2016 | 483 | 2016 |
| Band-gap engineering for removing shallow traps in rare-earth LuAlO garnet scintillators using Ga doping M Fasoli, A Vedda, M Nikl, C Jiang, BP Uberuaga, DA Andersson, ... Physical Review B—Condensed Matter and Materials Physics 84 (8), 081102, 2011 | 365 | 2011 |
| Synchronization of trajectories in canonical molecular-dynamics simulations: Observation, explanation, and exploitation BP Uberuaga, M Anghel, AF Voter The Journal of chemical physics 120 (14), 6363-6374, 2004 | 277 | 2004 |
| The relationship between grain boundary structure, defect mobility and grain boundary sink efficiency BP Uberuaga, LJ Vernon, E Martinez, AF Voter Scientific reports 5 (1), 9095, 2015 | 202 | 2015 |
| Accelerated molecular dynamics methods: introduction and recent developments D Perez, BP Uberuaga, Y Shim, JG Amar, AF Voter Annual Reports in computational chemistry 5, 79-98, 2009 | 200 | 2009 |
| Defect structure of flash‐sintered strontium titanate A Karakuscu, M Cologna, D Yarotski, J Won, JSC Francis, R Raj, ... Journal of the American Ceramic Society 95 (8), 2531-2536, 2012 | 195 | 2012 |
| Cooperativity among defect sites in and : Density functional calculations DA Andersson, J Lezama, BP Uberuaga, C Deo, SD Conradson Physical Review B—Condensed Matter and Materials Physics 79 (2), 024110, 2009 | 193 | 2009 |
| Direct transformation of vacancy voids to stacking fault tetrahedra BP Uberuaga, RG Hoagland, AF Voter, SM Valone Physical review letters 99 (13), 135501, 2007 | 186 | 2007 |
| U and Xe transport in UO: Density functional theory calculations DA Andersson, BP Uberuaga, PV Nerikar, C Unal, CR Stanek Physical Review B—Condensed Matter and Materials Physics 84 (5), 054105, 2011 | 182 | 2011 |
| First-principles prediction of disordering tendencies in pyrochlore oxides C Jiang, CR Stanek, KE Sickafus, BP Uberuaga Physical Review B—Condensed Matter and Materials Physics 79 (10), 104203, 2009 | 173 | 2009 |
| Comparison of screened hybrid density functional theory to diffusion Monte Carlo in calculations of total energies of silicon phases and defects ER Batista, J Heyd, RG Hennig, BP Uberuaga, RL Martin, GE Scuseria, ... Physical Review B—Condensed Matter and Materials Physics 74 (12), 121102, 2006 | 168 | 2006 |
| Vacancy-mediated dopant diffusion activation enthalpies for germanium A Chroneos, H Bracht, RW Grimes, BP Uberuaga Applied Physics Letters 92 (17), 2008 | 165 | 2008 |
| Stick-slip behavior of grain boundaries studied by accelerated molecular dynamics Y Mishin, A Suzuki, BP Uberuaga, AF Voter Physical Review B—Condensed Matter and Materials Physics 75 (22), 224101, 2007 | 144 | 2007 |
| Role of atomic structure on grain boundary-defect interactions in Cu XM Bai, LJ Vernon, RG Hoagland, AF Voter, M Nastasi, BP Uberuaga Physical Review B—Condensed Matter and Materials Physics 85 (21), 214103, 2012 | 138 | 2012 |
| Efficient Ab initio Modeling of Random Multicomponent Alloys C Jiang, BP Uberuaga Physical review letters 116 (10), 105501, 2016 | 132 | 2016 |
C.R. StanekLos Alamos National LaboratoryVerified email at lanl.gov
