Effects of defects on thermal decomposition of HMX via ReaxFF molecular dynamics simulations TT Zhou, FL Huang The Journal of Physical Chemistry B 115 (2), 278-287, 2011 | 147 | 2011 |
Anisotropic shock sensitivity for β-octahydro-1, 3, 5, 7-tetranitro-1, 3, 5, 7-tetrazocine energetic material under compressive-shear loading from ReaxFF-lg reactive dynamics … T Zhou, SV Zybin, Y Liu, F Huang, WA Goddard Journal of Applied Physics 111 (12), 2012 | 106 | 2012 |
Highly shocked polymer bonded explosives at a nonplanar interface: Hot-spot formation leading to detonation Q An, WA Goddard III, SV Zybin, A Jaramillo-Botero, T Zhou The Journal of Physical Chemistry C 117 (50), 26551-26561, 2013 | 103 | 2013 |
Hot spot formation and chemical reaction initiation in shocked HMX crystals with nanovoids: a large-scale reactive molecular dynamics study T Zhou, J Lou, Y Zhang, H Song, F Huang Physical Chemistry Chemical Physics 18 (26), 17627-17645, 2016 | 69 | 2016 |
Shock initiated thermal and chemical responses of HMX crystal from ReaxFF molecular dynamics simulation T Zhou, H Song, Y Liu, F Huang Physical Chemistry Chemical Physics 16 (27), 13914-13931, 2014 | 59 | 2014 |
Spall damage in single crystal Al with helium bubbles under decaying shock loading via molecular dynamics study TT Zhou, AM He, P Wang, JL Shao Computational Materials Science 162, 255-267, 2019 | 47 | 2019 |
Thermal decomposition mechanism of β-HMX under high pressures via ReaxFF reactive molecular dynamics simulations TT Zhou, YD Shi, FL Huang Wuli Huaxue Xuebao/Acta Physico-Chimica Sinica 28 (11), 2605-2615, 2012 | 37 | 2012 |
Accurate non-bonded potentials based on periodic quantum mechanics calculations for use in molecular simulations of materials and systems S Naserifar, JJ Oppenheim, H Yang, T Zhou, S Zybin, M Rizk, ... The Journal of Chemical Physics 151 (15), 2019 | 33 | 2019 |
Spall damage in single crystal tin under shock wave loading: A molecular dynamics simulation XX Wang, AM He, TT Zhou, P Wang Mechanics of Materials 160, 103991, 2021 | 31 | 2021 |
Predicted detonation properties at the Chapman–Jouguet state for proposed energetic materials (MTO and MTO3N) from combined ReaxFF and quantum mechanics reactive dynamics T Zhou, SV Zybin, WA Goddard, T Cheng, S Naserifar, A Jaramillo-Botero, ... Physical Chemistry Chemical Physics 20 (6), 3953-3969, 2018 | 28 | 2018 |
ReaxFF reactive molecular dynamics on silicon pentaerythritol tetranitrate crystal validates the mechanism for the colossal sensitivity T Zhou, L Liu, WA Goddard III, SV Zybin, F Huang Physical Chemistry Chemical Physics 16 (43), 23779-23791, 2014 | 26 | 2014 |
Dynamic evolution of He bubble and its effects on void nucleation-growth and thermomechanical properties in the spallation of aluminum TT Zhou, AM He, P Wang Journal of Nuclear Materials 542, 152496, 2020 | 23 | 2020 |
Thermal expansion behaviors and phase transitions of HMX polymorphs via ReaxFF molecular dynamics simulations TT Zhou, FL Huang Wuli Xuebao/Acta Physica Sinica 61 (24), 246501, 2012 | 20 | 2012 |
Anisotropic shock sensitivity in a single crystal δ-cyclotetramethylene tetranitramine: a reactive molecular dynamics study TT Zhou, JF Lou, HJ Song, FL Huang Physical Chemistry Chemical Physics 17 (12), 7924-7935, 2015 | 15 | 2015 |
All-atom, non-empirical, and tailor-made force field for α-RDX from first principles HJ Song, YG Zhang, H Li, T Zhou, FL Huang RSC advances 4 (76), 40518-40533, 2014 | 15 | 2014 |
Atomistic simulation and continuum modeling of the dynamic tensile fracture and damage evolution of solid single crystalline Al with He bubble T Zhou, F Zhao, H Zhou, F Zhang, P Wang International Journal of Mechanical Sciences 234, 107681, 2022 | 13 | 2022 |
高压下 β-HMX 热分解机理的 ReaxFF 反应分子动力学模拟 周婷婷, 石一丁, 黄风雷 物理化学学报 28 (11), 2605-2615, 2012 | 13 | 2012 |
The rupture and ejection of near-surface helium bubble in single crystal Cu under shock loading H Wu, T Zhou, P Wang Journal of Nuclear Materials 558, 153404, 2022 | 12 | 2022 |
Dynamic tensile fracture of liquid copper containing helium bubbles DD Jiang, TT Zhou, P Wang, AM He International Journal of Mechanical Sciences 232, 107585, 2022 | 11 | 2022 |
Reaction mechanisms and sensitivity of silicon nitrocarbamate and related systems from quantum mechanics reaction dynamics T Zhou, T Cheng, SV Zybin, WA Goddard III, F Huang Journal of Materials Chemistry A 6 (12), 5082-5097, 2018 | 10 | 2018 |