Description of the thermodynamic properties and fluid-phase behavior of aqueous solutions of linear,branched, and cyclic amines

The SAFT-γ Mie group-contribution equation of state is used to represent the fluid-phase behavior of aqueous solutions of a variety of linear, branched, and cyclic amines. New group interactions are developed in order to model the mixtures of interest, including the like and unlike interactions between alkyl primary, secondary, and tertiary amine groups (NH₂, NH, N), cyclic secondary and tertiary amine groups (cNH, cN), and cyclic methine-amine groups (cCHNH, cCHN) with water (H₂O). The group-interaction parameters are estimated from appropriate experimental thermodynamic data for pure amines and selected mixtures. By taking advantage of the group-contribution nature of the method, one can describe the fluid-phase behavior of mixtures of molecules comprising those groups over broad ranges of temperature, pressure, and composition. A number of aqueous solutions of amines are studied including linear, branched aliphatic, and cyclic amines. Liquid–liquid equilibria (LLE) bounded by lower critical solution temperatures (LCSTs) have been reported experimentally and are reproduced here with the SAFT-γ Mie approach. The main feature of the approach is the ability not only to represent accurately the experimental data employed in the parameter estimation, but also to predict the vapor–liquid, liquid–liquid, and vapor–liquid–liquid equilibria, and LCSTs with the same set of parameters. Pure compound and binary phase diagrams of diverse types of amines and their aqueous solutions are assessed in order to demonstrate the main features of the thermodynamic and fluid-phase behavior.     

N,N'-二(2-羟丙基)哌嗪-硫酸钠-水三元体系相平衡测定与计算

采用等温溶解平衡法测定N,N′-二(2-羟丙基)哌嗪(HPP)?Na2SO4?H2O三元体系在273.15和298.15 K下的相平衡数据，采用湿渣法测定其平衡固相数据，绘制等温相图。用改进的单组分电解质Pitzer方程计算该体系中Na2SO4和Na2SO4?10H2O的溶解平衡常数，并对相平衡数据进行理论计算。结果表明，273.15 K时存在3个结晶区，298.15 K时存在4个结晶区。HPP的存在降低了Na2SO4和Na2SO4?10H2O的相转变温度，使298.15 K下的相图中存在Na2SO4的结晶区域，且273.15和298.15 K的相图中不存在纯HPP的结晶区域。理论计算与实验数据的均方根偏差不高于0.0290，表明相平衡数据计算值与实验值较吻合，证实了改进的单组分电解质Pitzer方程适用于该体系计算。     

Mixed coordination mechanisms for scheduling games on hierarchical machines

In this paper, we study scheduling games under mixed coordination mechanisms on hierarchical machines. The two scheduling policies involved are ‐ and ‐, where ‐ (resp., ‐) policy sequences jobs in nondecreasing order of their hierarchies, and jobs of the same hierarchy in nonincreasing (resp., nondecreasing) order of their processing times. We first show the existence of a Nash equilibrium. Then we present the price of anarchy and the price of stability for the games with social costs of minimizing the makespan and maximizing the minimum machine load. All the bounds given in this paper are tight.     

Interfacial reactions in In-Sn/Ni couples and phase equilibria of the In-Sn-Ni system

The In-Sn-Ni alloys of various compositions were prepared and annealed at 160°C and 240°C. No ternary compounds were found; however, most of the binary compounds had extensive ternary solubility. There was a continuous solid solution between the Ni₃Sn phase and Ni₃In phase. The Sn-In/Ni couples, made of Sn-In alloys with various compositions, were reacted at 160°C and 240°C and formed only one compound for all the Sn-In alloys/Ni couples reacted up to 8 h. At 240°C, Ni₂₈In₇₂ phase formed in the couples made with pure indium, In-10at.%Sn and In-11at.%Sn alloys, while Ni₃Sn₄ phase formed in the couples made of alloys with compositions varied from pure Sn to In-12at.%Sn. At 160°C, except in the In/Ni couple, Ni₃Sn₄ formed by interfacial reaction.     

Two Isomers of C60F48: Computed Inter-isomeric Equilibrium

C₆₀F₄₈ has been known to exist in two isomeric forms of D₃ and S₆ symmetries. However, the quantum-chemical calculations have not agreed on their stability order though a near-isoenergetic picture is otherwise always encountered. In order to clarify the situation, the entropy effects are evaluated for synthetic temperatures of about 500K. The entropy evaluations suggest that the D₃ isomer should be more stable in the potential energy by 2.05-2.55 kcal/mol (to which term the ab initio data are closer than the semiempirical ones).     

Thermogravimetric Study of the M-Co-O System: I, M = Ta and Nb at 1200°C

Phase equilibria in the Ta-Co-O and Nb-Co-O systems have been studied at 1200°C at oxygen partial pressures from 10^−0.68 to 10^−13.50 atm for the former and from 10^−0.68 to 10^−13.30 atm for the latter. In both systems, M₂CoO₆ and M₂Co₄O₉ are stable ternary compounds under the experimental conditions, and a new phase, Nb₅Co₂O₁₄, has been identified. The Ta-Co-O system is simple, whereas the Nb-Co-O system is somewhat more complicated because of the extra phase. The lattice constants of the ternary compounds have been determined and compared with previous values. The standard Gibbs energies of reactions have been determined using oxygen partial pressures in equilibrium with three solid phases.     

Bubble-point pressures and liquid densities of binary R-125 + R-143a System

Bubble-point pressures and saturated-liquid densities of the binary R-135 (pentafuoroethane) + R- 143a ( 1, 1, 1-trifluoroethane) system have been measured for several compositions at temperatures from 280 to 330 K by means of a magnetic densimeter coupled with a variable-volume cell mounted with a metallic bellows. The experimental uncertainties of the temperature, pressure. and density measurements and the composition determination were estimated to be within ±15 mK, ±13 k Pa, ±0.2%, and ±0.1 wt%, respectively. The purities of the samples used throughout the measurements are 99.98 wt% for R-125 and 99.0 mol % for R- 143a. Based on the present data, the thermodynamic behavior of the vapor-liquid equilibria of this binary refrigerant mixture has been evaluated by using the Peng-Robinson equation for the bubble-point pressures, and the modified Hankinson-Brobst-Thomson equation for the saturated-liquid densities. This was done to identify the optimized binary interaction parameters.Paper presented at the Twelfth Symposium on Thermophysical Properties, June 19–24, 1994, Boulder, Colorado, U.S.A.     

Vapor-liquid equilibrium and volumetric properties calculations for solutions in the supercritical carbon dioxide

The calculations of gas solubilities in supercritical solvents require equations of state remaining accurate in the critical range, which are difficult to obtain with classical models. In this work, the Helmholtz energy of a mixture is considered as the sum of the Helmholtz energies of pure components taken at a constant packing fraction and of a residual term which may have the form of a RedlichKister, Van Laar, NRTL, UNIQUAC, or UNIFAC function. Thus it is possible to assign to a given component an equation of state whose form is different from that of the others. This model has been applied to binary systems containing supercritical carbon dioxide. The results are improved with respect to those obtained with the classical model for vapor-liquid equilibria and for volumetric properties.     

会计信息失真现象的博弈分析

在对现实进行合理假定的基础上建立了会计信息失真现象的有限完美信息动态博弈模型，并利用后退归纳法找到了五个满足不同条件的纳什均衡解。通过对均衡条件的分析，找出了导致会计信息失真的治理结构原因和法律制度因素，并提出了建设性的解决措施。     

Modeling the continuous melt transesterification of bisphenol-A and diphenyl carbonate in a continuous stirred tank reactor

A model of continuous melt transesterification of bisphenol-A and diphenyl carbonate in a continuous stirred tank reactor is developed using phase equilibria assumption and the method of molecular weight moments. The model equations can be simplified into a polynomial system that has 17 equations and 17 unknowns. Solution of the polynomial system gives out almost every aspects of the continuous transesterification process. Molecular weight and polydispersity index, end group ratio of hydroxyl to phenyl carbonate, contents of molecular species, and lost diphenyl carbonate fractions are studied in different operation parameters.