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Qijun Hong
Tytuł
Cytowane przez
Cytowane przez
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Evaluation of individual and ensemble probabilistic forecasts of COVID-19 mortality in the United States
EY Cramer, EL Ray, VK Lopez, J Bracher, A Brennen, ...
Proceedings of the National Academy of Sciences 119 (15), e2113561119, 2022
272*2022
CO2 fixation into methanol at Cu/ZrO2 interface from first principles kinetic Monte Carlo
QL Tang, QJ Hong, ZP Liu
Journal of Catalysis 263 (1), 114-122, 2009
2342009
Prediction of the material with highest known melting point from ab initio molecular dynamics calculations
QJ Hong, A Van De Walle
Physical Review B 92 (2), 020104, 2015
1722015
The United States COVID-19 forecast hub dataset
EY Cramer, Y Huang, Y Wang, EL Ray, M Cornell, J Bracher, A Brennen, ...
Scientific data 9 (1), 462, 2022
892022
Mechanism of CO2 hydrogenation over Cu/ZrO2 (212) interface from first-principles kinetics Monte Carlo simulations
QJ Hong, ZP Liu
Surface science 604 (21-22), 1869-1876, 2010
862010
Carbides and nitrides of zirconium and hafnium
SV Ushakov, A Navrotsky, QJ Hong, A van de Walle
Materials 12 (17), 2728, 2019
792019
Software tools for high-throughput CALPHAD from first-principles data
A van de Walle, R Sun, QJ Hong, S Kadkhodaei
Calphad 58, 70-81, 2017
772017
The free energy of mechanically unstable phases
A Van De Walle, Q Hong, S Kadkhodaei, R Sun
Nature communications 6 (1), 7559, 2015
702015
Solid-liquid coexistence in small systems: A statistical method to calculate melting temperatures
QJ Hong, A Van De Walle
The Journal of chemical physics 139 (9), 2013
672013
Combined computational and experimental investigation of high temperature thermodynamics and structure of cubic ZrO2 and HfO2
QJ Hong, SV Ushakov, D Kapush, CJ Benmore, RJK Weber, ...
Scientific reports 8 (1), 14962, 2018
472018
Free energy calculation of mechanically unstable but dynamically stabilized bcc titanium
S Kadkhodaei, QJ Hong, A Van De Walle
Physical Review B 95 (6), 064101, 2017
462017
Combined computational and experimental investigation of the refractory properties of La2Zr2O7
QJ Hong, SV Ushakov, A Navrotsky, A Van De Walle
Acta Materialia 84, 275-282, 2015
442015
A user guide for SLUSCHI: solid and liquid in ultra small coexistence with hovering interfaces
QJ Hong, A Van De Walle
Calphad 52, 88-97, 2016
342016
Equation of state of solid, liquid and gaseous tantalum from first principles
L Miljacic, S Demers, QJ Hong, A Van De Walle
Calphad 51, 133-143, 2015
292015
Melting temperature prediction using a graph neural network model: From ancient minerals to new materials
QJ Hong, SV Ushakov, A van de Walle, A Navrotsky
Proceedings of the National Academy of Sciences 119 (36), e2209630119, 2022
282022
Re-entrant melting of sodium, magnesium, and aluminum: General trend
QJ Hong, A van de Walle
Physical Review B 100, 140102, 2019
212019
A combined experimental and theoretical study of enthalpy of phase transition and fusion of yttria above 2000 C using “drop-n-catch” calorimetry and first-principles calculation
D Kapush, SV Ushakov, A Navrotsky, QJ Hong, H Liu, A van de Walle
Acta Materialia 124, 204-209, 2017
212017
Direct first-principles chemical potential calculations of liquids
QJ Hong, A Van De Walle
The Journal of chemical physics 137 (9), 2012
192012
Energetics of melting of Yb2O3 and Lu2O3 from drop and catch calorimetry and first principles computations
M Fyhrie, QJ Hong, D Kapush, SV Ushakov, H Liu, A van de Walle, ...
The Journal of Chemical Thermodynamics 132, 405-410, 2019
182019
Theoretical prediction of high melting temperature for a Mo–Ru–Ta–W HCP multiprincipal element alloy
QJ Hong, J Schroers, D Hofmann, S Curtarolo, M Asta, A van de Walle
npj Computational Materials 7 (1), 1, 2021
152021
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