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Molecular Physics

An International Journal at the Interface Between Chemistry and Physics

Volume 117, 2019 - Issue 23-24: Peter Cummings – A Pillar in the Field of Statistical Mechanics and Molecular Simulation

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Cummings Special Issue

Solute-induced effects in solvation thermodynamics: does urea behave as a structure-making or structure-breaking solute?

Ariel A. ChialvoKnoxville, USACorrespondence[email protected]

https://orcid.org/0000-0002-6091-4563

Oscar D. CrisalleDepartment of Chemical Engineering, University of Florida, Gainesville, FL, USA

Pages 3484-3492 | Received 28 Jan 2019, Accepted 04 Apr 2019, Published online: 19 Apr 2019

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https://doi.org/10.1080/00268976.2019.1606461
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Evgeny Ivanov, Elena Lebedeva, Arina Pakina & Nadezhda Ivanova. (2024) Comparative description of the extraordinary phenomenon "thermally activated isobaric partial structure compaction" of water as a solute in some alkanols and alkylamines. From Chemistry Towards Technology Step-By-Step 5:1, pages 85-106.
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Evgeniy V. Ivanov, Elena Yu. Lebedeva & Arina A. Pakina. (2024) Solutions of Urea in tert -Butylamine: The Phenomenon of “Partial Molar Isobaric Compaction of the Solute” According to Density Measurements between 278.15 and 303.15 K at Ambient Pressure . Journal of Chemical & Engineering Data 69:3, pages 933-941.
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Ariel A. Chialvo & Oscar D. Crisalle. (2023) On the molecular-based thermodynamics of dilute solutions along orthobaric conditions: Concise review of the fundamental microscopic constraints, rigorous formal results, and macroscopic modeling implications. Journal of Molecular Liquids 390, pages 122901.
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Ariel A. Chialvo & Oscar D. Crisalle. (2023) Linear orthobaric-density approach to the Krichevskii parameter of a solute from its vapor-liquid distribution coefficient: What can we learn about its accuracy from systems whose precise behavior is known?. Fluid Phase Equilibria 565, pages 113651.
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Ariel A. Chialvo & Oscar D. Crisalle. (2022) Solute-Induced Perturbation of the Solvent Microstructure in Aqueous Electrolyte Solutions: Some Uses and Misuses of Structure Making/Breaking Criteria. Liquids 2:3, pages 106-130.
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Ariel A. Chialvo & Oscar D. Crisalle. (2021) Osmolyte-Induced Effects on the Hydration Behavior and the Osmotic Second Virial Coefficients of Alkyl-Substituted Urea Derivatives: Critical Assessment of Their Structure-Making/Breaking Behavior. The Journal of Physical Chemistry B 125:23, pages 6231-6243.
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Ariel A. Chialvo & Oscar D. Crisalle. (2021) On density-based modeling of dilute non-electrolyte solutions involving wide ranges of state conditions and intermolecular asymmetries: Formal results, fundamental constraints, and the rationale for its molecular thermodynamic foundations. Fluid Phase Equilibria 535, pages 112969.
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Ariel A. Chialvo. (2020) On the Solvation Thermodynamics Involving Species with Large Intermolecular Asymmetries: A Rigorous Molecular-Based Approach to Simple Systems with Unconventionally Complex Behaviors. The Journal of Physical Chemistry B 124:36, pages 7879-7896.
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Ariel A. Chialvo. (2020) On the Krichevskii parameter of solutes in dilute solutions: Formal links between its magnitude, the solute-solvent intermolecular asymmetry, and the precise description of solution thermodynamics. Fluid Phase Equilibria 513, pages 112546.
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Ariel A. Chialvo & Oscar D. Crisalle. (2020) On the linear orthobaric-density representation of near-critical solvation quantities: What can we conclude about the accuracy of this paradigm?. Fluid Phase Equilibria 514, pages 112535.
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Evgeniy V. Ivanov, Andrey V. Kustov & Elena Yu Lebedeva. (2019) Solutions of Urea and Tetramethylurea in Formamide and Water: A Comparative Analysis of Volume Characteristics and Solute–Solute Interaction Parameters at Temperatures from 288.15 to 328.15 K and Ambient Pressure. Journal of Chemical & Engineering Data 64:12, pages 5886-5899.
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Ariel A. Chialvo & Oscar D. Crisalle. (2019) Solvation behavior of solutes in dilute solutions novel formal results, rules of thumb, and potential modeling pitfalls. Fluid Phase Equilibria 496, pages 17-30.
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Ariel Chialvo & Oscar D. Crisalle. (2022) Linear Orthobaric-Density Approach to the Krichevskii Parameter of a Solute from its Vapor-Liquid Distribution Coefficient:What Can We Learn About its Accuracy from Systems Whose Precise Behavior is Known?. SSRN Electronic Journal.
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Solute-induced effects in solvation thermodynamics: does urea behave as a structure-making or structure-breaking solute?

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Solute-induced effects in solvation thermodynamics: does urea behave as a structure-making or structure-breaking solute?

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