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MONTE-CARLO SIMULATION STUDIES OF BINARY-MIXTURES - A MEASURE OF THE MIXING
Date
1994-01-01
Author
Karaaslan, Hasan
YURTSEVER, E
Metadata
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A Monte Carlo algorithm tailored to fast equilibration of binary mixtures is applied to Lennard-Jones fluids and solids. In order to study phase transitions as functions of interaction parameters as well as of the temperature, a measure of the mixing is defined which is based on the normalized differences of radial distribution functions. At all temperatures sharp transitions are observed when the ratio of the interaction strengths of like and unlike particles reaches a threshold value.
Subject Keywords
Computer experiments
,
Liquids
URI
https://hdl.handle.net/11511/38546
Journal
BERICHTE DER BUNSEN-GESELLSCHAFT-PHYSICAL CHEMISTRY CHEMICAL PHYSICS
DOI
https://doi.org/10.1002/bbpc.19940980107
Collections
Department of Computer Education and Instructional Technology, Article