Search results for "Heat capacity"
showing 10 items of 90 documents
Simulation studies of fluid critical behaviour
1997
We review and discuss recent advances in the simulation of bulk critical phenomena in model fluids. In particular we emphasise the extensions to finite-size scaling theory needed to cope with the lack of symmetry between coexisting fluid phases. The consequences of this asymmetry for simulation measurements of quantities such as the particle density and the heat capacity are pointed out and the relationship to experiment is discussed. A general simulation strategy based on the finite-size scaling theory is described and its utility illustrated via Monte-Carlo studies of the Lennard-Jones fluid and a two-dimensional spin fluid model. Recent applications to critical polymer blends and solutio…
Thermodynamic studies of octyltrimethylammonium chloride in water
1992
Densities, heat capacities, enthalpies of dilution at 298 K and osmotic coefficients at 310 K of octyltrimethylammonium chloride were measured as functions of concentration. From the experimental data, the partial molar volumes, heat capacities, relative enthalpies, nonideal free energies and entropies at 298 K were derived as functions of concentration. A comparison between the above data and those of dodecyltrimethylammonium chloride reported in the literature shows that the increase of the alkyl chain length shifts the apparent molar volumevs. concentration curves towards greater values and the heat capacity, relative enthalpy and free energyvs. concentration curves towards smaller value…
Thermodynamic properties of some N-alkyl-N-methylpiperidinium chlorides and N-alkylpiperidine hydrochlorides in water
1993
Densities and heat capacities at 25[degrees]C were measured for N-octyl-, N-decyl- and N-dodecyl-N-methylpiperidinium chlorides and for N-octyl- and N-dodecylpiperidine hydrochlorides in water as functions of concentration. Enthalpies of dilution at 25[degrees]C and osmotic coefficients at 37[degrees]C of the N-methyl-N-alkylpiperidinium chlorides were also measured as functions of concentration. The partial molar volumes, heat capacities, relative enthalpies, nonideal Gibbs energies and entropies at 25[degrees]C were derived as functions of the surfactant concentration. By increasing the alkyl chain length of the surfactant, both the apparent molar volume vs. concentration curves are shift…
Thermodynamics ofN,N,N-octylpentyldimethyl-ammonium chloride in water-urea mixtures
1997
Specific conductivities, densities, heat capacities, and enthalpies of dilution at 25‡C were measured forN,N,N-octylpentyldimethylammonium chloride (OPAC) in water-urea mixtures at various urea concentrations mu as functions of the surfactant concentration ms. From conductivity data, the cmc and the degree of the counterion dissociation Β of the OPAC micelles were calculated. The cmc increases linearly with increasingm u while Βvs. mu is a smooth concave curve. From the experimental thermodynamic data, the apparentY Φ and partialY 2 molar properties (volumes, heat capacities, and relative enthalpies) are derived as functions of mu andm s . The effect of urea on the dependences of the differ…
Heat Capacity Study to Evidence the Interactions between Cyclodextrin and Surfactant in the Monomeric and Micellized States
2003
The heat capacities of transfer (ΔCpt) of hydroxypropyl-α-cyclodextrin and hydroxypropyl-γ-cyclodextrin (0.05 mol kg-1) from water to aqueous solutions of sodium hexanoate, sodium decanoate, and so...
Heat capacities, volumes and solubilities of pentanol in aqueous alkyltrimethylammonium bromides
1988
Apparent molar heat capacities and volumes of pentanol, 0.05m in decyl-, tetradecyl- and hexadecyltrimethylammonium bromides micellar solutions, were measured at 25°C. They were assumed to approach the standard infinite dilution values and rationalized by means of previously reported equations following which the distribution constant between the aqueous and the micellar phase, heat capacity, and volume of pentanol in both phases are simultaneously derived. The present results show that the volume of the micellar core does not seem to have a significant effect on the apparent molar volume and heat capacity of pentanol in the micellar phase and on the free energy of transfer of pentanol from…
Thermodynamic Properties of Sodium n-Alkanecarboxylates in Water and in Water + Cyclodextrins Mixtures
1998
Densities and heat capacities of water−substrate, water−cyclodextrin, and water−substrate−cyclodextrin systems were determined at 298 K. The substrates studied are sodium n-alkanecarboxylates (CnCOONa) (from sodium acetate to sodium decanoate) and the cyclodextrins are hydroxypropyl-α-cyclodextrin (HP-α-CD), hydroxypropyl-β-cyclodextrin, (HP-β-CD), hydroxypropyl-γ-cyclodextrin (HP-γ-CD) and β-cyclodextrin (β-CD). The apparent molar volumes and heat capacities of CnCOONa in water were calculated as functions of concentration. The standard partial molar properties agree with those obtained by using the additivity rule. HP-β-CD essentially does not affect the thermodynamic properties of C1COON…
N,N,N-Alkyloctyldimethylammonium Chlorides in Water: A Thermodynamic Investigation
1993
Abstract Specific conductivities, densities, heat capacities and enthalpies of dilution at 298 K and osmotic coefficients at 310 K were measured for N,N,N -octylbutyldimethylammonium, N,N,N -octylpentyldimethylammonium, and N,N -dioctyldimethylammonium chlorides in water as functions of concentration. From the specific conductivity data, the CMC and the degree of the counterion dissociation have been calculated. It is shown that additional CH 2 groups in the variable alkyl chain affect both CMC and β less than they do in the single chain surfactants. The partial molar volumes, heat capacities, relative enthalpies, nonideal free energies, and entropies at 298 K were derived as functions of t…
Volume and heat capacity studies to evidence interactions between cyclodextrins and nicotinic acid in water
2008
Density and heat capacity of the water+cyclodextrin (CD), water+nicotinic acid (NA) and water+CD+NA mixtures were determined at 298.15 K. CDs with different cavity size and alkylation were selected. From the experimental data the apparent molar properties were calculated. Assuming the formation of inclusion complexes of 1:1 stoichiometry, these properties were modeled and provided the stability constants of CD/NA inclusion complexes and the corresponding property change. The binding of NA with the smallest sized alpha-cyclodextrin (alpha-CD) generates more stable complexes accompanied by the lower volume and the heat capacity changes. These results are in agreement with earlier proposed bin…
Volumes and heat capacities of the aqueous sodium dodecanoate/sodium perfluorooctanoate mixtures in the presence of β-cyclodextrin
2003
Apparent molar volumes (VΦ) and heat capacities (CΦ) of the sodium dodecanoate (NaL)/sodium perfluorooctanoate (NaPFO) mixtures in the water/β-cyclodextrin (β-CD) solvent as functions of the surfactant total molality (mt) were determined at 25°C. For a given surfactant mixture, VΦ decreases with mt to ca. 0.05 mol kg−1 thereafter it increases tending to a constant value. CΦ displays a behaviour opposite to VΦ. The mt values where the apparent molar properties exhibit extrema are nearly coincident with the critical micellar concentrations determined by conductivity. An equation correlating VΦ to mt was derived by assuming that the equilibria for the 1∶1 surfactant/cyclodextrin complex format…