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Publications

Found 9 results
Filters: Keyword is 1st-principles  [Clear All Filters]
2015
I. Kalay, Kramer, M. J., and Napolitano, R. E., Crystallization Kinetics and Phase Transformation Mechanisms in Cu56Zr44 Glassy Alloy, Metallurgical and Materials Transactions a-Physical Metallurgy and Materials Science, vol. 46A, pp. 3356-3364, 2015.
X. Zhao, Wu, S. Q., Lv, X. B., Nguyen, M. C., Wang, C. Z., Lin, Z. J., Zhu, Z. Z., and Ho, K. M., Exploration of tetrahedral structures in silicate cathodes using a motif-network scheme, Scientific Reports, vol. 5, p. 15555, 2015.
L. Z. Zhao, Lu, W. C., Su, W. S., Qin, W., Wang, C. Z., and Ho, K. M., Si-78 double cage structure and special optical properties, Physical Chemistry Chemical Physics, vol. 17, pp. 27734-27741, 2015.