| An improved potential energy surface and multi-temperature quasiclassical trajectory calculations of N2+ N2 dissociation reactions JD Bender, P Valentini, I Nompelis, Y Paukku, Z Varga, DG Truhlar, ... The Journal of chemical physics 143 (5), 2015 | 212 | 2015 |
| Direct molecular simulation of nitrogen dissociation based on an ab initio potential energy surface P Valentini, TE Schwartzentruber, JD Bender, I Nompelis, GV Candler Physics of Fluids 27 (8), 2015 | 125 | 2015 |
| Phase-transition plasticity response in uniaxially compressed silicon nanospheres P Valentini, WW Gerberich, T Dumitrică Physical review letters 99 (17), 175701, 2007 | 101 | 2007 |
| Direct molecular simulation of nonequilibrium dilute gases TE Schwartzentruber, MS Grover, P Valentini Journal of Thermophysics and Heat Transfer 32 (4), 892-903, 2018 | 93 | 2018 |
| Dynamics of nitrogen dissociation from direct molecular simulation P Valentini, TE Schwartzentruber, JD Bender, GV Candler Physical Review Fluids 1 (4), 043402, 2016 | 78 | 2016 |
| GPU-accelerated classical trajectory calculation direct simulation Monte Carlo applied to shock waves P Norman, P Valentini, T Schwartzentruber Journal of Computational Physics 247, 153-167, 2013 | 61 | 2013 |
| Molecular dynamics simulation of rotational relaxation in nitrogen: Implications for rotational collision number models P Valentini, C Zhang, TE Schwartzentruber Physics of Fluids 24 (10), 2012 | 61 | 2012 |
| Rovibrational coupling in molecular nitrogen at high temperature: An atomic-level study P Valentini, P Norman, C Zhang, TE Schwartzentruber Physics of Fluids 26 (5), 2014 | 54 | 2014 |
| Large-scale molecular dynamics simulations of normal shock waves in dilute argon P Valentini, TE Schwartzentruber Physics of Fluids 21 (6), 2009 | 54 | 2009 |
| Molecular dynamics simulation of O2 sticking on Pt (111) using the ab initio based ReaxFF reactive force field P Valentini, TE Schwartzentruber, I Cozmuta The Journal of chemical physics 133 (8), 2010 | 53 | 2010 |
| Dissipative particle dynamics simulation of a colloidal micropump P De Palma, P Valentini, M Napolitano Physics of Fluids 18 (2), 2006 | 45 | 2006 |
| Comparison of Potential Energy Surface and Computed Rate Coefficients for Dissociation RL Jaffe, M Grover, S Venturi, DW Schwenke, P Valentini, ... Journal of thermophysics and heat transfer 32 (4), 869-881, 2018 | 40 | 2018 |
| Microscopic theory for nanoparticle-surface collisions in crystalline silicon P Valentini, T Dumitrică Physical Review B 75 (22), 224106, 2007 | 39 | 2007 |
| ReaxFF Grand Canonical Monte Carlo simulation of adsorption and dissociation of oxygen on platinum (111) P Valentini, TE Schwartzentruber, I Cozmuta Surface science 605 (23-24), 1941-1950, 2011 | 37 | 2011 |
| A combined Event-Driven/Time-Driven molecular dynamics algorithm for the simulation of shock waves in rarefied gases P Valentini, TE Schwartzentruber Journal of Computational Physics 228 (23), 8766-8778, 2009 | 35 | 2009 |
| Uncertainty analysis of reaction rates in a finite-rate surface-catalysis model C Sorensen, P Valentini, TE Schwartzentruber Journal of Thermophysics and Heat Transfer 26 (3), 407-416, 2012 | 31 | 2012 |
| Comparison of quantum mechanical and empirical potential energy surfaces and computed rate coefficients for N2 dissociation RL Jaffe, DW Schwenke, M Grover, P Valentini, TE Schwartzentruber, ... 54th AIAA Aerospace Sciences Meeting, 0503, 2016 | 27 | 2016 |
| Ab initio simulation of hypersonic flows past a cylinder based on accurate potential energy surfaces MS Grover, P Valentini Physics of Fluids 33 (5), 2021 | 22 | 2021 |
| Nonequilibrium-direction-dependent rotational energy model for use in continuum and stochastic molecular simulation C Zhang, P Valentini, TE Schwartzentruber AIAA journal 52 (3), 604-617, 2014 | 21 | 2014 |
| Molecular dynamics simulations of shock waves in mixtures of noble gases P Valentini, PA Tump, C Zhang, TE Schwartzentruber Journal of thermophysics and heat transfer 27 (2), 226-234, 2013 | 21 | 2013 |
Tom SchwartzentruberProfessor of Aerospace Engineering and Mechanics, University of MinnesotaVerified email at aem.umn.edu
