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Order-disorder effects on the equation of state for fcc Ni-Al alloys
Geng, HY ; Sluiter, MHF ; Chen, NX
2010-05-06 ; 2010-05-06
关键词CONFIGURATIONAL HEAT-CAPACITY POROUS MATERIALS PHASE-STABILITY DEPENDENCE SYSTEM DIAGRAM Physics, Condensed Matter
中文摘要Order-disorder effects on equation of state (EOS) properties of substitutional binary alloys are investigated with the cluster variation method (CVM) based on ab initio effective cluster interactions (ECI). Calculations are applied to the fcc based system. Various related quantities are shown to vary with concentration around stoichiometry with a surprising "W shape," such as the thermal expansion coefficient, the heat capacity, and the Gruneisen parameter, due to configurational ordering effects. Analysis shows that this feature originates from the dominated behavior of some elements of the inverse of Hessian matrix, and relates to antisite defects occurring around stoichiometric compositions. This kind of strong compositional effects on EOS properties highlights the importance of subtle thermodynamic behavior of order-disorder systems.
语种英语 ; 英语
出版者AMERICAN PHYSICAL SOC ; COLLEGE PK ; ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA
内容类型期刊论文
源URL[http://hdl.handle.net/123456789/15284]  
专题清华大学
推荐引用方式
GB/T 7714
Geng, HY,Sluiter, MHF,Chen, NX. Order-disorder effects on the equation of state for fcc Ni-Al alloys[J],2010, 2010.
APA Geng, HY,Sluiter, MHF,&Chen, NX.(2010).Order-disorder effects on the equation of state for fcc Ni-Al alloys..
MLA Geng, HY,et al."Order-disorder effects on the equation of state for fcc Ni-Al alloys".(2010).
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