Order-disorder transition inCu3Au: A combined molecular-dynamics and cluster-variation-method approach

1993 ◽  
Vol 47 (21) ◽  
pp. 14541-14544 ◽  
Author(s):  
Fabrizio Cleri ◽  
Giorgio Mazzone ◽  
Vittorio Rosato
1992 ◽  
Vol 291 ◽  
Author(s):  
Fabrizio Cleri ◽  
Giorgio Mazzone ◽  
Vittorio Rosato Enea

ABSTRACTThe order-disorder transformation in CU3Au has been investigated using a combined Molecular Dynamics and Cluster Variation Method approach. Free energy minimization has been performed using the Natural Iteration technique. The calculated temperature dependence of enthalpy, lattice dynamics, short-range and long-range order parameters have been successfully compared with experimental data.


2001 ◽  
Vol 42 (11) ◽  
pp. 2157-2164 ◽  
Author(s):  
V. M. Mati´c ◽  
L. T. Wille ◽  
N. Dj. Lazarov ◽  
M. Mili´c

1983 ◽  
Vol 28 (5) ◽  
pp. 565-568 ◽  
Author(s):  
J S Desjardins ◽  
O Steinsvoll

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