Theoretical investigation on structural and thermodynamic properties of the intermetallic compound in Mg–Zn–Ag alloy under high pressure and high temperature

作者: Zhi-Wen Lu , Da-Wei Zhou , Jian-Ping Bai , Cheng Lu , Zhi-Guo Zhong

DOI: 10.1016/J.JALLCOM.2012.10.165

关键词: Grüneisen parameterThermal expansionThermodynamicsDebye modelPhase (matter)IntermetallicMaterials scienceHeat capacityAlloyInternal energyMechanical engineeringMaterials ChemistryMechanics of MaterialsMetals and Alloys

摘要: A theoretical investigation on structural and thermodynamic properties of intermetallic compounds MgAg, Mg4Zn8 and Mg4Zn4Ag8 in Mg–Zn–Ag alloy at high pressure and high …

参考文章(37)
L. Zhu, Z. Wang, Y. Wang, G. Zou, H.-k. Mao, Y. Ma, Spiral chain O4 form of dense oxygen Proceedings of the National Academy of Sciences of the United States of America. ,vol. 109, pp. 751- 753 ,(2012) , 10.1073/PNAS.1119375109
Meng-Meng Wu, Yi Jiang, Ji-Wei Wang, Jian Wu, Bi-Yu Tang, Li-Ming Peng, Wen-Jiang Ding, Structural, elastic and electronic properties of Mg(Cu1−xZnx)2 alloys calculated by first-principles Journal of Alloys and Compounds. ,vol. 509, pp. 2885- 2890 ,(2011) , 10.1016/J.JALLCOM.2010.11.148
Yanming Ma, Yanchao Wang, Jian Lv, Li Zhu, Crystal structure prediction via particle-swarm optimization Physical Review B. ,vol. 82, pp. 094116- ,(2010) , 10.1103/PHYSREVB.82.094116
Junxian Zhang, Benjamin Villeroy, Bernard Knosp, Patrick Bernard, Michel Latroche, Structural and chemical analyses of the new ternary La5MgNi24 phase synthesized by Spark Plasma Sintering and used as negative electrode material for Ni-MH batteries International Journal of Hydrogen Energy. ,vol. 37, pp. 5225- 5233 ,(2012) , 10.1016/J.IJHYDENE.2011.12.096
A. Atkinson, R. I. Taylor, A. E. Hughes, A quantitative demonstration of the grain boundary diffusion mechanism for the oxidation of metals Philosophical Magazine. ,vol. 45, pp. 823- 833 ,(1982) , 10.1080/01418618208239905
T. M. Pollock, Weight Loss with Magnesium Alloys Science. ,vol. 328, pp. 986- 987 ,(2010) , 10.1126/SCIENCE.1182848
G. Kresse, J. Furthmüller, Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set. Physical Review B. ,vol. 54, pp. 11169- 11186 ,(1996) , 10.1103/PHYSREVB.54.11169