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Found 43 results
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2014
S. Q. Wu, Ji, M., Wang, C. Z., Nguyen, M. C., Zhao, X., Umemoto, K., Wentzcovitch, R. M., and Ho, K. M., An adaptive genetic algorithm for crystal structure prediction, Journal of Physics-Condensed Matter, vol. 26, p. 035402, 2014.
F. S. Ke, Yue, G. Q., Shen, B., Dong, F., Wang, S. Y., Zheng, Y. X., Chen, L. Y., Wang, C. Z., and Ho, K. M., Bergman-type medium-range order in rapidly quenched Ag0.74Ge0.26 eutectic alloy studied by ab initio molecular dynamics simulation, Acta Materialia, vol. 80, pp. 498-504, 2014.
F. Zhang, Ji, M., Fang, X. W., Sun, Y., Wang, C. Z., Mendelev, M. I., Kramer, M. J., Napolitano, R. E., and Ho, K. M., Composition-dependent stability of the medium-range order responsible for metallic glass formation, Acta Materialia, vol. 81, pp. 337-344, 2014.
Y. X. Yao, Liu, J., Wang, C. Z., and Ho, K. M., Correlation matrix renormalization approximation for total-energy calculations of correlated electron systems, Physical Review B, vol. 89, p. 045131, 2014.
F. Zhang, McBrearty, I., Ott, R. T., Park, E., Mendelev, M. I., Kramer, M. J., Wang, C. Z., and Ho, K. M., Discovery of a meta-stable Al-Sm phase with unknown stoichiometry using a genetic algorithm, Scripta Materialia, vol. 81, pp. 32-35, 2014.
F. Zhang, Mendelev, M. I., Zhang, Y., Wang, C. Z., Kramer, M. J., and Ho, K. M., Effects of sub-T-g annealing on Cu64.5Zr35.5 glasses: A molecular dynamics study, Applied Physics Letters, vol. 104, p. 061905, 2014.
D. X. Zhang, Shen, B., Zheng, Y. X., Wang, S. Y., Zhang, J. B., Yang, S. D., Zhang, R. J., Chen, L. Y., Wang, C. Z., and Ho, K. M., Evolution of optical properties of tin film from solid to liquid studied by spectroscopic ellipsometry and ab initio calculation, Applied Physics Letters, vol. 104, p. 121907, 2014.
X. Zhao, Nguyen, M. C., Zhang, W. Y., Wang, C. Z., Kramer, M. J., Sellmyer, D. J., Li, X. Z., Zhang, F., Ke, L. Q., Antropov, V. P., and Ho, K. M., Exploring the Structural Complexity of Intermetallic Compounds by an Adaptive Genetic Algorithm, Physical Review Letters, vol. 112, p. 045502, 2014.
M. C. Nguyen, Zhao, X., Wang, Y. G., Wang, C. Z., and Ho, K. M., Genetic algorithm prediction of crystal structure of metastable Si-IX phase, Solid State Communications, vol. 182, pp. 14-16, 2014.
Y. Zhang, Mendelev, M. I., Wang, C. Z., Ott, R., Zhang, F., Besser, M., Ho, K. M., and Kramer, M. J., Impact of deformation on the atomic structures and dynamics of a Cu-Zr metallic glass: A molecular dynamics study, Physical Review B, vol. 90, p. 174101, 2014.
X. Zhao, Shu, Q., Nguyen, M. C., Wang, Y. G., Ji, M., Xiang, H. J., Ho, K. M., Gong, X. G., and Wang, C. Z., Interface Structure Prediction from First-Principles, Journal of Physical Chemistry C, vol. 118, pp. 9524-9530, 2014.
N. Lanata, Yao, Y. X., Wang, C. Z., Ho, K. M., and Kotliar, G., Interplay of spin-orbit and entropic effects in cerium, Physical Review B, vol. 90, p. 161104, 2014.
X. J. Liu, Wang, C. Z., Lin, H. Q., and Ho, K. M., Magnetic Moment Enhancement for Mn-7 Cluster on Graphene, Journal of Physical Chemistry C, vol. 118, pp. 19123-19128, 2014.
B. Shen, Liu, C. Y., Jia, Y., Yue, G. Q., Ke, F. S., Zhao, H. B., Chen, L. Y., Wang, S. Y., Wang, C. Z., and Ho, K. M., Molecular dynamics simulation studies of structural and dynamical properties of rapidly quenched Al, Journal of Non-Crystalline Solids, vol. 383, pp. 13-20, 2014.
M. C. Nguyen, Zhao, X., Wang, C. Z., and Ho, K. M., New Be-intercalated hexagonal boron layer structure of BeB2, Rsc Advances, vol. 4, pp. 15061-15065, 2014.
X. Zhao, Nguyen, M. C., Wang, C. Z., and Ho, K. M., New stable Re-B phases for ultra-hard materials, Journal of Physics-Condensed Matter, vol. 26, p. 455401, 2014.
M. T. Hershberger, Hupalo, M., Thiel, P. A., Wang, C. Z., Ho, K. M., and Tringides, M. C., Nucleation in Pb/Si(111) at Low Temperatures, Physical Review Letters, vol. 113, p. 236101, 2014.
A. G. Kusne, Gao, T. R., Mehta, A., Ke, L. Q., Nguyen, M. C., Ho, K. M., Antropov, V., Wang, C. Z., Kramer, M. J., Long, C., and Takeuchi, I., On-the-fly machine-learning for high-throughput experiments: search for rare-earth-free permanent magnets, Scientific Reports, vol. 4, p. 6367, 2014.
X. Z. Li, Zhang, W. Y., Sellmyer, D. J., Zhao, X., Nguyen, M. C., Wang, C. Z., and Ho, K. M., Orthorhombic Zr2Co11 phase revisited, Journal of Alloys and Compounds, vol. 611, pp. 167-170, 2014.
X. J. Liu, Wang, C. Z., Hupalo, M., Lin, H. Q., Ho, K. M., and Tringides, M. C., Quantum confinement induced oscillatory electric field on a stepped Pb(111) film and its influence on surface reactivity, Physical Review B, vol. 89, p. 041401, 2014.
M. C. Nguyen, Zhao, X., Wang, C. Z., and Ho, K. M., sp(3)-hybridized framework structure of group-14 elements discovered by genetic algorithm, Physical Review B, vol. 89, p. 184112, 2014.
Y. Zhang, Wang, C. Z., Zhang, F., Mendelev, M. I., Kramer, M. J., and Ho, K. M., Strong correlations of dynamical and structural heterogeneities with localized soft modes in a Cu-Zr metallic glass, Applied Physics Letters, vol. 105, p. 151910, 2014.
X. W. Fang, Huang, L., Wang, C. Z., Ho, K. M., and Ding, Z. J., Structure of Cu64.5Zr35.5 metallic glass by reverse Monte Carlo simulations, Journal of Applied Physics, vol. 115, p. 053522, 2014.
X. J. Liu, Wang, C. Z., Lin, H. Q., Hupalo, M., Thiel, P. A., Ho, K. M., and Tringides, M. C., Structures and magnetic properties of Fe clusters on graphene, Physical Review B, vol. 90, p. 155444, 2014.
F. Zhang, Wood, B. C., Wang, Y., Wang, C. Z., Ho, K. M., and Chou, M. Y., Ultrafast Bulk Diffusion of AlHx in High-Entropy Dehydrogenation Intermediates of NaAlH4, Journal of Physical Chemistry C, vol. 118, pp. 18356-18361, 2014.

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