First-principles study, fabrication and characterization of (Zr0. 25Nb0. 25Ti0. 25V0. 25) C high-entropy ceramics B Ye, T Wen, MC Nguyen, L Hao, CZ Wang, Y Chu
Acta Materialia 170, 15-23, 2019
406 2019 On-the-fly machine-learning for high-throughput experiments: search for rare-earth-free permanent magnets AG Kusne, T Gao, A Mehta, L Ke, MC Nguyen, KM Ho, V Antropov, ...
Scientific reports 4, 6367, 2014
317 2014 An adaptive genetic algorithm for crystal structure prediction SQ Wu, M Ji, CZ Wang, MC Nguyen, X Zhao, K Umemoto, ...
Journal of Physics: Condensed Matter 26 (3), 035402, 2013
220 2013 Exploring the structural complexity of intermetallic compounds by an adaptive genetic algorithm X Zhao, MC Nguyen, WY Zhang, CZ Wang, MJ Kramer, DJ Sellmyer, ...
Physical review letters 112 (4), 045502, 2014
134 2014 New Layered Structures of Cuprous Chalcogenides as Thin Film Solar Cell Materials: <?format ?> MC Nguyen, JH Choi, X Zhao, CZ Wang, Z Zhang, KM Ho
Physical review letters 111 (16), 165502, 2013
128 2013 Ab initio study of dihydrogen binding in metal-decorated polyacetylene for hydrogen storageH Lee, WI Choi, MC Nguyen, MH Cha, E Moon, J Ihm
Physical Review B—Condensed Matter and Materials Physics 76 (19), 195110, 2007
120 2007 Thermophysical and mechanical properties of novel high‐entropy metal nitride‐carbides T Wen, B Ye, MC Nguyen, M Ma, Y Chu
Journal of the American Ceramic Society 103 (11), 6475-6489, 2020
104 2020 Development of interatomic potentials appropriate for simulation of devitrification of Al90Sm10 alloy MI Mendelev, F Zhang, Z Ye, Y Sun, MC Nguyen, SR Wilson, CZ Wang, ...
Modelling and Simulation in Materials Science and Engineering 23 (4), 045013, 2015
82 2015 Ferromagnetic Quantum Critical Point Avoided by the Appearance of Another Magnetic Phase in V Taufour, US Kaluarachchi, R Khasanov, MC Nguyen, Z Guguchia, ...
Physical review letters 117 (3), 037207, 2016
70 2016 Elastic and electronic tuning of magnetoresistance in MoTe2 J Yang, J Colen, J Liu, MC Nguyen, G Chern, D Louca
Science advances 3 (12), eaao4949, 2017
63 2017 Role of Surface Stress on the Reactivity of Anatase TiO2 (001) Y Shi, H Sun, WA Saidi, MC Nguyen, CZ Wang, K Ho, J Yang, J Zhao
The Journal of Physical Chemistry Letters 8 (8), 1764-1771, 2017
46 2017 Interface structure prediction from first-principles X Zhao, Q Shu, MC Nguyen, Y Wang, M Ji, H Xiang, KM Ho, X Gong, ...
The Journal of Physical Chemistry C 118 (18), 9524-9530, 2014
46 2014 Hydrogen storage in Ca-decorated, B-substituted metal organic framework X Zou, MH Cha, S Kim, MC Nguyen, G Zhou, W Duan, J Ihm
international journal of hydrogen energy 35 (1), 198-203, 2010
45 2010 Titanium-functional group complexes for high-capacity hydrogen storage materials H Lee, MC Nguyen, J Ihm
Solid state communications 146 (9-10), 431-434, 2008
39 2008 Robust diamond-like Fe-Si network in the zero-strain NaxFeSiO4 cathode Z Ye, X Zhao, S Li, S Wu, P Wu, MC Nguyen, J Guo, J Mi, Z Gong, ZZ Zhu, ...
Electrochimica Acta 212, 934-940, 2016
36 2016 Exploration of tetrahedral structures in silicate cathodes using a motif-network scheme X Zhao, S Wu, X Lv, MC Nguyen, CZ Wang, Z Lin, ZZ Zhu, KM Ho
Scientific reports 5, 15555, 2015
36 2015 Structures of defects on anatase TiO 2 (001) surfaces Y Shi, H Sun, MC Nguyen, C Wang, K Ho, WA Saidi, J Zhao
Nanoscale 9 (32), 11553-11565, 2017
35 2017 Magnetocrystalline anisotropy in cobalt based magnets: a choice of correlation parameters and the relativistic effects MC Nguyen, Y Yao, CZ Wang, KM Ho, VP Antropov
Journal of Physics: Condensed Matter 30 (19), 195801, 2018
33 2018 Structures and stabilities of alkaline earth metal peroxides XO 2 (X= Ca, Be, Mg) studied by a genetic algorithm X Zhao, MC Nguyen, CZ Wang, KM Ho
RSC advances 3 (44), 22135-22139, 2013
33 2013 Iron-decorated, functionalized metal organic framework for high-capacity hydrogen storage: First-principles calculations MH Cha, MC Nguyen, YL Lee, J Im, J Ihm
The Journal of Physical Chemistry C 114 (33), 14276-14280, 2010
33 2010 