Qi An
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Shock-induced plasticity in tantalum single crystals: Interatomic potentials and large-scale molecular-dynamics simulations
R Ravelo, TC Germann, O Guerrero, Q An, BL Holian
Physical Review B 88 (13), 134101, 2013
Observing crystal nucleation in four dimensions using atomic electron tomography
J Zhou, Y Yang, Y Yang, D Kim, A Yuan, X Tian, C Ophus, F Sun, ...
Nature 570, 500–503, 2019
Ultrathin WO30.33H2O Nanotubes for CO2 Photoreduction to Acetate with High Selectivity
S Sun, M Watanabe, J Wu, Q An, T Ishihara
Journal of the American Chemical Society 140 (20), 6474-6482, 2018
Shock-induced spall in solid and liquid Cu at extreme strain rates
SN Luo, Q An, TC Germann, LB Han
Journal of Applied Physics 106 (1), 013502, 2009
Efficient photocatalytic reduction of dinitrogen to ammonia on bismuth monoxide quantum dots
S Sun, Q An, W Wang, L Zhang, J Liu, WA Goddard III
Journal of Materials Chemistry A 5 (1), 201-209, 2017
Atomistic explanation of shear-induced amorphous band formation in boron carbide
Q An, WA Goddard III, T Cheng
Physical review letters 113 (9), 095501, 2014
Nanometallic glasses: size reduction brings ductility, surface state drives its extent
DZ Chen, D Jang, KM Guan, Q An, WA Goddard III, JR Greer
Nano letters 13 (9), 4462-4468, 2013
Atomistic origin of brittle failure of boron carbide from large-scale reactive dynamics simulations: Suggestions toward improved ductility
Q An, WA Goddard III
Physical review letters 115 (10), 105501, 2015
Fractal atomic-level percolation in metallic glasses
DZ Chen, CY Shi, Q An, Q Zeng, WL Mao, WA Goddard III, JR Greer
Science 349 (6254), 1306-1310, 2015
Elucidation of the dynamics for hot-spot initiation at nonuniform interfaces of highly shocked materials
Q An, SV Zybin, WA Goddard III, A Jaramillo-Botero, M Blanco, SN Luo
Physical Review B 84 (22), 220101, 2011
Melting of Cu under hydrostatic and shock wave loading to high pressures
Q An, SN Luo, LB Han, L Zheng, O Tschauner
Journal of Physics: Condensed Matter 20 (9), 095220, 2008
Reaction mechanism and kinetics for ammonia synthesis on the Fe (111) surface
J Qian, Q An, A Fortunelli, RJ Nielsen, WA Goddard III
Journal of the American Chemical Society 140 (20), 6288-6297, 2018
Initial steps of thermal decomposition of dihydroxylammonium 5, 5′-bistetrazole-1, 1′-diolate crystals from quantum mechanics
Q An, WG Liu, WA Goddard III, T Cheng, SV Zybin, H Xiao
The Journal of Physical Chemistry C 118 (46), 27175-27181, 2014
The co-crystal of TNT/CL-20 leads to decreased sensitivity toward thermal decomposition from first principles based reactive molecular dynamics
D Guo, Q An, SV Zybin, WA Goddard III, F Huang, B Tang
Journal of Materials Chemistry A 3 (10), 5409-5419, 2015
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
Anisotropic shock response of columnar nanocrystalline Cu
SN Luo, TC Germann, TG Desai, DL Tonks, Q An
Journal of Applied Physics 107 (12), 123507, 2010
Anisotropic shock sensitivity of cyclotrimethylene trinitramine (RDX) from compress-and-shear reactive dynamics
Q An, Y Liu, SV Zybin, H Kim, WA Goddard III
The Journal of Physical Chemistry C 116 (18), 10198-10206, 2012
Shock wave loading and spallation of copper bicrystals with asymmetric tilt grain boundaries
SN Luo, TC Germann, DL Tonks, Q An
Journal of Applied Physics 108 (9), 093526, 2010
Grain boundary sliding and amorphization is responsible for the reverse Hall-Petch relation in superhard nanocrystalline boron carbide
D Guo, S Song, R Luo, WA Goddard III, M Chen, KM Reddy, Q An
Physical Review Letters 121, 145504, 2018
Compressive shear reactive molecular dynamics studies indicating that cocrystals of TNT/CL-20 decrease sensitivity
D Guo, Q An, WA Goddard III, SV Zybin, F Huang
The Journal of Physical Chemistry C 118 (51), 30202-30208, 2014
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