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| First-principles study of thermodynamic properties and solubility of aluminum-rare-earth intermetallics 期刊论文
Computational Materials Science, 2014, 卷号: 90, 页码: 56-60
Authors: X. D. Zhang; S. Q. Wang
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| Computational materials discovery: the case of the W-B system 期刊论文
Acta Crystallographica Section C-Crystal Structure Communications, 2014, 卷号: 70, 页码: 85-U50
Authors: X. Y. Cheng; X. Q. Chen; D. Z. Li; Y. Y. Li
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| Variable-composition structural optimization and experimental verification of MnB3 and MnB4 期刊论文
Physical Chemistry Chemical Physics, 2014, 卷号: 16, 期号: 30, 页码: 15866-15873
Authors: H. Y. Niu; X. Q. Chen; W. J. Ren; Q. Zhu; A. R. Oganov; D. Z. Li; Y. Y. Li
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| First-principles study of ground-state properties of U2Mo 期刊论文
Physical Chemistry Chemical Physics, 2014, 卷号: 16, 期号: 48, 页码: 26974-26982
Authors: X. Wang; X. Y. Cheng; Y. T. Zhang; R. H. Li; W. W. Xing; P. C. Zhang; X. Q. Chen
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| The microstructure, stability, and elastic properties of 14H long-period stacking-ordered phase in Mg-Zn-Y alloys: a first-principles study 期刊论文
Journal of Materials Science, 2014, 卷号: 49, 期号: 2, 页码: 737-748
Authors: S. Y. Ma; L. M. Liu; S. Q. Wang
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| Selective Hydrogenation of Cinnamaldehyde to Cinnamal Alcohol over Platinum/Graphene Catalysts 期刊论文
Chemcatchem, 2014, 卷号: 6, 期号: 11, 页码: 3246-3253
Authors: X. W. Ji; X. Y. Niu; B. Li; Q. Han; F. L. Yuan; F. Zaera; Y. J. Zhu; H. G. Fu
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| Surface Structural Reconstruction for Optical Response in Iodine-Modified TiO2 Photocatalyst System 期刊论文
Journal of Physical Chemistry C, 2014, 卷号: 118, 期号: 25, 页码: 13726-13732
Authors: L. J. Zhang; J. Zhou; J. Li; G. Liu; X. Lin; B. H. Mao; R. D. Liu; S. Zhang; J. Q. Wang
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| Atomic-scale configurations of synchroshear-induced deformation twins in the ionic MnS crystal 期刊论文
Scientific Reports, 2014, 卷号: 4
Authors: Y. T. Zhou; Y. B. Xue; D. Chen; Y. J. Wang; B. Zhang; X. L. Ma
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| Revisit of the relationship between the elastic properties and sound velocities at high pressures 期刊论文
Journal of Applied Physics, 2014, 卷号: 116, 期号: 10
Authors: C. J. Wang; S. K. Xiang; J. B. Gu; X. Y. Kuang; Y. Yu; X. Z. Yan; H. Y. Chen
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| Molecular dynamics simulations of influence of Re on lattice trapping and fracture stress of cracks in Ni 期刊论文
Computational Materials Science, 2014, 卷号: 83, 页码: 196-206
Authors: Z. G. Liu; C. Y. Wang; T. Yu
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