Qi An, Ph.D.
Affiliations: | 2012 | Materials Science | California Institute of Technology, Pasadena, CA |
Area:
Theoretical chemistryGoogle:
"Qi An"Mean distance: 8.15 | S | N | B | C | P |
Parents
Sign in to add mentorWilliam A. Goddard | grad student | 2012 | Caltech | |
(Atomistic Simulations of Material Properties under Extreme Conditions.) |
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Publications
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Shen Y, Morozov SI, Camacho-Mojica DC, et al. (2023) Growth Mechanism and Kinetics of Diamond in Liquid Gallium from Quantum Mechanics Molecular Dynamics Simulations. Acs Applied Materials & Interfaces. 15: 33046-33055 |
Cheng Y, Dong J, Li F, et al. (2023) Scaling Law for Impact Resistance of Amorphous Alloys Connecting Atomistic Molecular Dynamics with Macroscale Experiments. Acs Applied Materials & Interfaces |
Fuller J, An Q, Fortunelli A, et al. (2022) Reaction Mechanisms, Kinetics, and Improved Catalysts for Ammonia Synthesis from Hierarchical High Throughput Catalyst Design. Accounts of Chemical Research |
An Q, Johnson WL, Samwer K, et al. (2021) The L-G phase transition in binary Cu-Zr metallic liquids. Physical Chemistry Chemical Physics : Pccp. 24: 497-506 |
Lindley SA, An Q, Goddard WA, et al. (2021) Spatiotemporal Temperature and Pressure in Thermoplasmonic Gold Nanosphere-Water Systems. Acs Nano |
Karre R, Guo D, Song S, et al. (2021) Vacancy-driven shear localization in silicon nitride Scripta Materialia. 190: 163-167 |
An Q, McDonald M, Fortunelli A, et al. (2020) Controlling the Shapes of Nanoparticles by Dopant-Induced Enhancement of Chemisorption and Catalytic Activity: Application to Fe-Based Ammonia Synthesis. Acs Nano |
An Q, Mcdonald M, Fortunelli A, et al. (2020) Si-doped Fe Catalyst for Ammonia Synthesis at Dramatically Decreased Pressures and Temperatures. Journal of the American Chemical Society |
An Q, Johnson WL, Samwer K, et al. (2020) First Order Phase Transition in Liquid Ag to the Heterogeneous G-Phase. The Journal of Physical Chemistry Letters |
Guo D, Zybin SV, Goddard WA, et al. (2020) Enhancing the Detonation Properties of Liquid Nitromethane by Adding Nitro-Rich Molecule Nitryl Cyanide The Journal of Physical Chemistry C. 124: 9787-9794 |