Densities(ρ) and dynamic viscosities(η) for three binary mixtures of n-decane with 1-pentanol,1-hexanol and1-heptanol are presented at temperatures from 293.15 to 363.15 K and atmospheric pressure over the entire co...Densities(ρ) and dynamic viscosities(η) for three binary mixtures of n-decane with 1-pentanol,1-hexanol and1-heptanol are presented at temperatures from 293.15 to 363.15 K and atmospheric pressure over the entire composition range.The density and viscosity are measured using a vibrating tube densimeter and a cylindrical Couette type rotating viscometer,respectively.Excess molar volumes(V^E),viscosity deviations(△η) and excess Gibbs energy of activation of viscous flow(△G^(*E)) are calculated from the experimental measurements.Intermolecular and structural interactions are indicated by the sign and magnitude of these properties.Partial molar volumes and infinity dilution molar partial volumes are also calculated for each binary system.These results are correlated using Redlich-Kister type equations.展开更多
An enhanced KR-fundamental measure functional （FMF） is elaborated and employed to investigate binary and ternary hard sphere fluids near a planar hard wall or confined within two planar hard walls separated by certa...An enhanced KR-fundamental measure functional （FMF） is elaborated and employed to investigate binary and ternary hard sphere fluids near a planar hard wall or confined within two planar hard walls separated by certain interval. The present enhanced KR-FMF incorporates respectively, for aim of comparison, a recent 3rd-order expansion equation of state （EOS） and a Boublfk＇s extension of Kolafa＇s EOS for HS mixtures. It is indicated that the two versions of the EOS lead to, in the framework of the enhanced KR-FMF, similar density profiles, but the 3rd-order EOS is more consistent with an exact scaled particle theory （SPT） relation than the BK EOS. Extensive comparison between the enhanced KR-FMF-3rd-order EOS predictions and corresponding density profiles produced in different periods indicates the excellent performance of the present enhanced KR-FMF-3rd-order EOS in comparison with other available density functional approximations （DFAs）. There are two anomalous situations from whose density profiles all DFAs studied deviate significantly; however, subsequent new computer simulation results for state conditions similar to the two anomalous situations are in very excellent agreement with the present enhanced KR-FMF-3rd-order EOS. The present paper indicates that （i） the validity of the ＂naive＂ substitution elaborated in the present paper and peculiar to the original KR-FMF is still in operation even if inhomogeneoas mixtures are being dealt with; （ii） the high accuracy and self-consistency of the third order EOS seem to allow for application of the KR-FMF-third order EOS to more severe state conditions; and （iii） the ＂naive＂ substitution enables very easy the combination of the original KR-FMF with future＇s more accurate but potentially more complicated EOS of hard sphere mixtures.展开更多
基金Supported by the National Council of Science and Technology(CONACyT)(SEP-2004-C01-47817)
文摘Densities(ρ) and dynamic viscosities(η) for three binary mixtures of n-decane with 1-pentanol,1-hexanol and1-heptanol are presented at temperatures from 293.15 to 363.15 K and atmospheric pressure over the entire composition range.The density and viscosity are measured using a vibrating tube densimeter and a cylindrical Couette type rotating viscometer,respectively.Excess molar volumes(V^E),viscosity deviations(△η) and excess Gibbs energy of activation of viscous flow(△G^(*E)) are calculated from the experimental measurements.Intermolecular and structural interactions are indicated by the sign and magnitude of these properties.Partial molar volumes and infinity dilution molar partial volumes are also calculated for each binary system.These results are correlated using Redlich-Kister type equations.
基金Supported by the National Natural Science Foundation of China under Grant No.20973202
文摘An enhanced KR-fundamental measure functional （FMF） is elaborated and employed to investigate binary and ternary hard sphere fluids near a planar hard wall or confined within two planar hard walls separated by certain interval. The present enhanced KR-FMF incorporates respectively, for aim of comparison, a recent 3rd-order expansion equation of state （EOS） and a Boublfk＇s extension of Kolafa＇s EOS for HS mixtures. It is indicated that the two versions of the EOS lead to, in the framework of the enhanced KR-FMF, similar density profiles, but the 3rd-order EOS is more consistent with an exact scaled particle theory （SPT） relation than the BK EOS. Extensive comparison between the enhanced KR-FMF-3rd-order EOS predictions and corresponding density profiles produced in different periods indicates the excellent performance of the present enhanced KR-FMF-3rd-order EOS in comparison with other available density functional approximations （DFAs）. There are two anomalous situations from whose density profiles all DFAs studied deviate significantly; however, subsequent new computer simulation results for state conditions similar to the two anomalous situations are in very excellent agreement with the present enhanced KR-FMF-3rd-order EOS. The present paper indicates that （i） the validity of the ＂naive＂ substitution elaborated in the present paper and peculiar to the original KR-FMF is still in operation even if inhomogeneoas mixtures are being dealt with; （ii） the high accuracy and self-consistency of the third order EOS seem to allow for application of the KR-FMF-third order EOS to more severe state conditions; and （iii） the ＂naive＂ substitution enables very easy the combination of the original KR-FMF with future＇s more accurate but potentially more complicated EOS of hard sphere mixtures.
