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Derivation of operational definitions for the computer calculation of partial molar properties in multicomponent mixtures

โœ Scribed by Pablo G. Debenedetti


Publisher
Elsevier Science
Year
1986
Tongue
English
Weight
337 KB
Volume
132
Category
Article
ISSN
0009-2614

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โœฆ Synopsis


Two sets of fluctuation-explicit operational definitions for partial molar enthalpies, energies and volumes are derived. The equations are valid for multicomponent and binary mixtures, respectively, and allow the calculation of partial molar volumes, energies, and enthalpies through both deterministic and stochastic computer simulations.


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