Predictive molecular thermodynamic models for liquid solvents, solid salts, polymers, and ionic liquids

Z Lei, B Chen, C Li, H Liu - Chemical reviews, 2008 - ACS Publications
Generally, molecular thermodynamic models for treating the phase equilibria of solutions
can be classified into two categories: activity coefficient relations and equations of state. The …

Fast solvent screening via quantum chemistry: COSMO‐RS approach

F Eckert, A Klamt - AIChE Journal, 2002 - Wiley Online Library
COSMO‐RS, a general and fast methodology for the a priori prediction of thermophysical
data of liquids is presented. It is based on cheap unimolecular quantum chemical …

Studies of eutectic hydrated salt/polymer hydrogel composite as form-stable phase change material for building thermal energy storage

G Sang, H Zeng, Z Guo, H Cui, Y Zhang, X Cui… - Journal of Building …, 2022 - Elsevier
The inorganic phase change material (PCM) is a promising energy storage material in the
construction field because of their characteristics, such as high latent heat, low price and …

Volumetric, transport and acoustic properties of binary mixtures containing alkanol at 298.15–318.15 K

S Verma, A Sharma, S Maken - Journal of Molecular Liquids, 2023 - Elsevier
The measurement of density (ρ), viscosity (η) and ultrasonic speed (u) have been conducted
at T= 298.15 K–318.15 K and at 0.1 MPa to study the intermolecular interactions between p …

Acoustic, volumetric, compressibility and refractivity properties and reduction parameters for the ERAS and Flory models of some homologous series of amines from …

SL Oswal, P Oswal, RL Gardas, SG Patel… - Fluid phase equilibria, 2004 - Elsevier
The speeds of sound u, densities ρ and refractive indices nD of homologous series of mono-
, di-, and tri-alkylamines were measured in the temperature range from 298.15 to 328.15 K …

Thermodynamics of mixtures with strongly negative deviations from Raoult's Law: Part 4. Application of the DISQUAC model to mixtures of 1-alkanols with primary or …

JA González, IG de la Fuentá, JC Cobos - Fluid phase equilibria, 2000 - Elsevier
Binary mixtures of 1-alkanols with primary or secondary linear amines have been
characterized in the framework of DISQUAC. The interaction parameters for the …

Dielectric and refractive index measurements for the systems 1-pentanol+ octane, or+ dibutyl ether or for dibutyl ether+ octane at different temperatures

V Alonso, JA González, IG de la Fuente, JC Cobos - Thermochimica acta, 2012 - Elsevier
Relative permittivities, ɛr and refractive indices, nD, have been measured at (288.15–
308.15) K and (293.15–303.15) K, respectively, for the mixtures 1-pentanol+ octane, or+ …

Densities, speed of sound, and IR studies of Ethyl lactate with 2-alkoxyethanols at different temperatures

P Anila, KR Reddy, GS Rao, PVS Sairam… - Thermochimica …, 2015 - Elsevier
Densities and speeds of sound of the binary liquid mixtures of Ethyl lactate (EL) with 2-
methoxyethanol (2-ME), 2-ethoxyethanol (2-EE) and 2-butoxyethanol (2-BE) have been …

Investigation on vapor–liquid equilibria for binary systems of metal ion-containing ionic liquid [bmim] Zn2Cl5/NH3 by experiment and modified UNIFAC model

W Chen, S Liang, Y Guo, X Gui, D Tang - Fluid Phase Equilibria, 2013 - Elsevier
Total pressures of binary solutions of [bmim] Zn 2 Cl 5 (1)/NH 3 (2) at ammonia mole
fractions of x 2=(0.83–0.94) for T=(323.15–563.15) K at interval of 20 K were measured by a …

Thermal performance of an absorption-refrigeration system with [emim] Cu2Cl5/NH3 as working fluid

W Chen, Y Bai - Energy, 2016 - Elsevier
The vapor pressures of [emim] Cu 2 Cl 5/NH 3 at ammonia mole fractions (x 1) ranging from
0.90 to 0.96 at temperatures (T) ranging from 303.15 K to 483.15 K were determined by …