Standard thermodynamic properties of solutes in supercritical solvents: Simulation and theory

We report a modified simulation procedure to calculate partial molar quantities of dilute solutions in supercritical fluids through the Krichevskii function. This procedure circumvents the difficulties posed by the very large solvent compressibility and expansivity in the near-critical region of the...

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Detalles Bibliográficos
Autores principales:	Alvarez, J.L., Fernández-Prini, R., Marceca, E.
Formato:	JOUR
Materias:	solvent aqueous solution article calculation physical chemistry simulation solute standard supercritical fluid theory thermodynamics
Acceso en línea:	http://hdl.handle.net/20.500.12110/paper_00092614_v381_n5-6_p771_Alvarez
Aporte de:	Biblioteca Digital - Facultad de Ciencias Exactas y Naturales (UBA) de Universidad de Buenos Aires

id	todo:paper_00092614_v381_n5-6_p771_Alvarez
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spelling	todo:paper_00092614_v381_n5-6_p771_Alvarez2023-10-03T14:08:21Z Standard thermodynamic properties of solutes in supercritical solvents: Simulation and theory Alvarez, J.L. Fernández-Prini, R. Marceca, E. solvent aqueous solution article calculation physical chemistry simulation solute standard supercritical fluid theory thermodynamics We report a modified simulation procedure to calculate partial molar quantities of dilute solutions in supercritical fluids through the Krichevskii function. This procedure circumvents the difficulties posed by the very large solvent compressibility and expansivity in the near-critical region of the solutions where other simulation procedures cannot be used. © 2003 Elsevier B.V. All rights reserved. Fil:Fernández-Prini, R. Universidad de Buenos Aires. Facultad de Ciencias Exactas y Naturales; Argentina. Fil:Marceca, E. Universidad de Buenos Aires. Facultad de Ciencias Exactas y Naturales; Argentina. JOUR info:eu-repo/semantics/openAccess http://creativecommons.org/licenses/by/2.5/ar http://hdl.handle.net/20.500.12110/paper_00092614_v381_n5-6_p771_Alvarez
institution	Universidad de Buenos Aires
institution_str	I-28
repository_str	R-134
collection	Biblioteca Digital - Facultad de Ciencias Exactas y Naturales (UBA)
topic	solvent aqueous solution article calculation physical chemistry simulation solute standard supercritical fluid theory thermodynamics
spellingShingle	solvent aqueous solution article calculation physical chemistry simulation solute standard supercritical fluid theory thermodynamics Alvarez, J.L. Fernández-Prini, R. Marceca, E. Standard thermodynamic properties of solutes in supercritical solvents: Simulation and theory
topic_facet	solvent aqueous solution article calculation physical chemistry simulation solute standard supercritical fluid theory thermodynamics
description	We report a modified simulation procedure to calculate partial molar quantities of dilute solutions in supercritical fluids through the Krichevskii function. This procedure circumvents the difficulties posed by the very large solvent compressibility and expansivity in the near-critical region of the solutions where other simulation procedures cannot be used. © 2003 Elsevier B.V. All rights reserved.
format	JOUR
author	Alvarez, J.L. Fernández-Prini, R. Marceca, E.
author_facet	Alvarez, J.L. Fernández-Prini, R. Marceca, E.
author_sort	Alvarez, J.L.
title	Standard thermodynamic properties of solutes in supercritical solvents: Simulation and theory
title_short	Standard thermodynamic properties of solutes in supercritical solvents: Simulation and theory
title_full	Standard thermodynamic properties of solutes in supercritical solvents: Simulation and theory
title_fullStr	Standard thermodynamic properties of solutes in supercritical solvents: Simulation and theory
title_full_unstemmed	Standard thermodynamic properties of solutes in supercritical solvents: Simulation and theory
title_sort	standard thermodynamic properties of solutes in supercritical solvents: simulation and theory
url	http://hdl.handle.net/20.500.12110/paper_00092614_v381_n5-6_p771_Alvarez
work_keys_str_mv	AT alvarezjl standardthermodynamicpropertiesofsolutesinsupercriticalsolventssimulationandtheory AT fernandezprinir standardthermodynamicpropertiesofsolutesinsupercriticalsolventssimulationandtheory AT marcecae standardthermodynamicpropertiesofsolutesinsupercriticalsolventssimulationandtheory
_version_	1807318942034690048

Standard thermodynamic properties of solutes in supercritical solvents: Simulation and theory

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