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Found 96 results
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2018
X. B. Lv, Ye, Z., Sun, Y., Zhang, F., Yang, L., Lin, Z. J., Wang, C. Z., and Ho, K. M., “A comparative study of Sm networks in Al-10 at.%Sm glass and associated crystalline phases”, Philosophical Magazine Letters, vol. 98, pp. 27-37, 2018.
T. Q. Wen, Sun, Y., Ye, B. L., Tang, L., Yang, Z. J., Ho, K. M., Wang, C. Z., and Wang, N., “Cooling rate dependence of structural order in Ni62Nb38 metallic glass”, Journal of Applied Physics, vol. 123, p. 045108, 2018.
X. Zhao, Liu, J., Yao, Y. X., Wang, C. Z., and Ho, K. M., “Correlation matrix renormalization theory for correlated-electron materials with application to the crystalline phases of atomic hydrogen”, Physical Review B, vol. 97, p. 075142, 2018.
C. Qiao, Guo, Y. R., Dong, F., Wang, J. J., Shen, H., Wang, S. Y., Xu, M., Miao, X. S., Zheng, Y. X., Zhang, R. J., Chen, L. Y., Wang, C. Z., and Ho, K. M., “Evolution of short- and medium-range order in the melt-quenching amorphization of Ge2Sb2Te5”, Journal of Materials Chemistry C, vol. 6, pp. 5001-5011, 2018.
X. B. Lv, Zhao, X., Wu, S. Q., Nguyen, M. C., Zhu, Z. Z., Lin, Z. J., Wang, C. Z., and Ho, K. M., “Fe-Si networks and charge/discharge-induced phase transitions in Li2FeSiO4 cathode materials”, Physical Chemistry Chemical Physics, vol. 20, pp. 14557-14563, 2018.
W. Zhang, Lu, W. C., Zhang, H. X., Ho, K. M., and Wang, C. Z., “Hydrogen adatom interaction on graphene: A first principles study”, Carbon, vol. 131, pp. 137-141, 2018.
L. Yang, Zhang, F., Wang, C. Z., Ho, K. M., and Travesset, A., “Implementation of metal-friendly EAM/FS-type semi-empirical potentials in HOOMD-blue: AGPU-accelerated molecular dynamics software”, Journal of Computational Physics, vol. 359, pp. 352-360, 2018.
M. Sakurai, Zhao, X., Wang, C. Z., Ho, K. M., and Chelikowsky, J. R., “Influence of nitrogen dopants on the magnetization of Co3N clusters”, Physical Review Materials, vol. 2, p. 024401, 2018.
Y. Sun, Ye, Z., Zhang, F., Ding, Z. J., Wang, C. Z., Kramer, M. J., and Ho, K. M., “Investigation of partitionless growth of epsilon-Al60Sm11 phase in Al-10at% Sm liquid”, Modelling and Simulation in Materials Science and Engineering, vol. 26, p. 015006, 2018.
T. Q. Wen, Zhang, Y., Wang, C. Z., Wang, N., Ho, K. M., and Kramer, M. J., “Local structure orders and glass forming ability of Ni-Nb liquids”, Intermetallics, vol. 98, pp. 131-138, 2018.
M. C. Nguyen, Yao, Y. X., Wang, C. Z., Ho, K. M., and Antropov, V. P., “Magnetocrystalline anisotropy in cobalt based magnets: a choice of correlation parameters and the relativistic effects”, Journal of Physics-Condensed Matter, vol. 30, p. 195801, 2018.
M. I. Mendelev, Zhang, F., Song, H., Sun, Y., Wang, C. Z., and Ho, K. M., “Molecular dynamics simulation of the solid-liquid interface migration in terbium”, Journal of Chemical Physics, vol. 148, p. 214705, 2018.
J. H. Zhang, Wang, C. Z., Zhu, Z. Z., Liu, Q. H., and Ho, K. M., “Multimode Jahn-Teller effect in bulk systems: A case of the NV0 center in diamond”, Physical Review B, vol. 97, p. 165204, 2018.
S. Yu, Zhao, X., Wu, S. Q., Nguyen, M. C., Zhu, Z. Z., Wang, C. Z., and Ho, K. M., “New structures of Fe3S for rare-earth-free permanent magnets”, Journal of Physics D-Applied Physics, vol. 51, p. 075001, 2018.
H. Song, Sun, Y., Zhang, F., Wang, C. Z., Ho, K. M., and Mendelev, M. I., “Nucleation of stoichiometric compounds from liquid: Role of the kinetic factor”, Physical Review Materials, vol. 2, p. 8, 2018.
Y. Sun, Song, H. J., Zhang, F., Yang, L., Ye, Z., Mendelev, M. I., Wang, C. Z., and Ho, K. M., “Overcoming the Time Limitation in Molecular Dynamics Simulation of Crystal Nucleation: A Persistent-Embryo Approach”, Physical Review Letters, vol. 120, p. 085703, 2018.
M. C. Nguyen, Chen, C., Zhao, X., Liu, J., Wang, C. Z., and Ho, K. M., “Prediction of novel stable Fe-V-Si ternary phase”, Journal of Alloys and Compounds, vol. 732, pp. 567-572, 2018.
L. Yang, Sun, Y., Ye, Z., Zhang, F., Mendelev, M. I., Wang, C. Z., and Ho, K. M., “A self-contained algorithm for determination of solid-liquid equilibria in an alloy system”, Computational Materials Science, vol. 150, pp. 353-357, 2018.
B. Q. Song, Nguyen, M. C., Wang, C. Z., and Ho, K. M., “Stability of the 1144 phase in iron pnictides”, Physical Review B, vol. 97, p. 094105, 2018.
L. Tang, Wen, T. Q., Wang, N., Sun, Y., Zhang, F., Yang, Z. J., Ho, K. M., and Wang, C. Z., “Structural and chemical orders in Ni64.5Zr35.5 metallic glass by molecular dynamics simulation”, Physical Review Materials, vol. 2, p. 033601, 2018.
F. Zhang, Sun, Y., Wang, X. D., Cao, Q. P., Jiang, J. Z., Wang, C. Z., and Ho, K. M., “Structural connection between gallium crystals and near-T-m liquids under ambient pressure”, Scripta Materialia, vol. 143, pp. 86-89, 2018.
Y. R. Guo, Dong, F., Qiao, C., Wang, J. J., Wang, S. Y., Xu, M., Zheng, Y. X., Zhang, R. J., Chen, L. Y., Wang, C. Z., and Ho, K. M., “Structural signature and transition dynamics of Sb2Te3 melt upon fast cooling”, Physical Chemistry Chemical Physics, vol. 20, pp. 11768-11775, 2018.
X. Gui, Zhao, X., Sobczak, Z., Wang, C. Z., Klimczuk, T., Ho, K. M., and Xie, W. W., “Ternary Bismuthide SrPtBi2: Computation and Experiment in Synergism to Explore Solid-State Materials”, Journal of Physical Chemistry C, vol. 122, pp. 5057-5063, 2018.
M. C. Nguyen, Taufour, V., Bud'ko, S. L., Canfield, P. C., Antropov, V. P., Wang, C. Z., and Ho, K. M., “Using first-principles calculations to screen for fragile magnetism: Case study of LaCrGe3 and LaCrSb3”, Physical Review B, vol. 97, p. 184401, 2018.
2017
M. C. Nguyen, Zhou, L., Tang, W., Kramer, M. J., Anderson, I. E., Wang, C. Z., and Ho, K. M., “Cluster-Expansion Model for Complex Quinary Alloys: Application to Alnico Permanent Magnets”, Physical Review Applied, vol. 8, p. 054016, 2017.

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