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Publications

Found 128 results
Filters: Author is Wang, C. Z.  [Clear All Filters]
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.
S. J. Deng, Yang, F., Zhang, Q. H., Zhong, Y., Zeng, Y. X., Lin, S. W., Wang, X. L., Lu, X. H., Wang, C. Z., Gu, L., Xia, X. H., and Tu, J. P., Phase Modulation of (1T-2H)-MoSe2/TiC-C Shell/Core Arrays via Nitrogen Doping for Highly Efficient Hydrogen Evolution Reaction, Advanced Materials, vol. 30, p. 1802223, 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. Xiang, Ribeiro, R. A., Kaluarachchi, U. S., Gati, E., Nguyen, M. C., Wang, C. Z., Ho, K. M., Bud'ko, S. L., and Canfield, P. C., Pressure-induced multiple phase transformations of the BaBi3 superconductor, Physical Review B, vol. 98, p. 214509, 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.
L. Yang, Zhang, F., Meng, F. Q., Zhou, L., Sun, Y., Zhao, X., Ye, Z., Kramer, M. J., Wang, C. Z., and Ho, K. M., Spatially-correlated site occupancy in the nonstoichiometric meta-stable epsilon-Al60Sm11 phase during devitrification of Al-10.2 at.% Sm glasses, Acta Materialia, vol. 156, pp. 97-103, 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.
S. P. Wang, Xue, X. Y., Wang, C. Z., and Lu, W. C., A stable C2/m phase of H2S at 150-175 GPa, Japanese Journal of Applied Physics, vol. 57, p. 083101, 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.
Z. J. Yang, Wu, S. Q., Zhao, X., Nguyen, M. C., Yu, S., Wen, T. Q., Tang, L., Li, F. X., Ho, K. M., and Wang, C. Z., Structures and magnetic properties of iron silicide from adaptive genetic algorithm and first-principles calculations, Journal of Applied Physics, vol. 124, p. 073901, 2018.
F. Yang, Yang, L., Ai, C. Z., Xie, P. C., Lin, S. W., Wang, C. Z., and Lu, X. H., Tailoring Bandgap of Perovskite BaTiO3 by Transition Metals Co-Doping for Visible-Light Photoelectrical Applications: A First-Principles Study, Nanomaterials, vol. 8, p. 455, 2018.
Y. Sun, Zhang, F., Song, H. J., Mendelev, M. I., Wang, C. Z., and Ho, K. M., Temperature dependence of the solid-liquid interface free energy of Ni and Al from molecular dynamics simulation of nucleation, Journal of Chemical Physics, vol. 149, p. 6, 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.
M. Kim, Wang, C. Z., and Ho, K. M., Coexistence of type-II Dirac point and weak topological phase in Pt3Sn, Physical Review B, vol. 96, p. 205107, 2017.
R. Skomski, Ke, L. Q., Kramer, M. J., Anderson, I. E., Wang, C. Z., Zhang, W. Y., Shield, J. E., and Sellmyer, D. J., Cooperative and noncooperative magnetization reversal in alnicos, Aip Advances, vol. 7, p. 056222, 2017.
T. Q. Wen, Tang, L., Sun, Y., Ho, K. M., Wang, C. Z., and Wang, N., Crystal genes in a marginal glass-forming system of Ni50Zr50, Physical Chemistry Chemical Physics, vol. 19, pp. 30429-30438, 2017.
Z. Zhu, Wu, P., Wu, S. Q., Xu, L. H., Xu, Y. X., Zhao, X., Wang, C. Z., and Ho, K. M., An Efficient Scheme for Crystal Structure Prediction Based on Structural Motifs, Journal of Physical Chemistry C, vol. 121, pp. 11891-11896, 2017.
S. Q. Wu, Balamurugan, B., Zhao, X., Yu, S., Nguyen, M. C., Sun, Y., Valloppilly, S. R., Sellmyer, D. J., Ho, K. M., and Wang, C. Z., Exploring new phases of Fe3-xCoxC for rare-earth-free magnets, Journal of Physics D-Applied Physics, vol. 50, p. 215005, 2017.
X. Zhao, Wang, C. Z., Kim, M., and Ho, K. M., Fe-Cluster Compounds of Chalcogenides: Candidates for Rare-Earth-Free Permanent Magnet and Magnetic Nodal-Line Topological Material, Inorganic Chemistry, vol. 56, pp. 14577-14583, 2017.
F. Yang, Lin, S. W., Yang, L., Liao, J. J., Chen, Y. J., and Wang, C. Z., First-principles investigation of metal-doped cubic BaTiO3, Materials Research Bulletin, no. 245421, pp. 372-378, 2017.

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