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Special issue - Proceedings of the Ninth International Conference on Properties and Phase Equilibria for Product and Process Design - Preface Nakanishi K, Arai Y, Miyano Y |
3 - 14 |
Towards a theory of sustainable systems Cabezas H, Fath BD |
15 - 29 |
Thermophysical properties - Industrial directions Dohrn R, Pfohl O |
31 - 41 |
Molecular thermodynamics and bioprocessing: from intracellular events to bioseparations Blanch HW, Prausnitz JM, Curtis RA, Bratko D |
43 - 59 |
Property modelling and simulation for product and process design Gani R, Pistikopoulos EN |
61 - 75 |
The use of quantum chemistry to predict phase behavior for environmental and process engineering Sandler SI, Lin ST, Sum AK |
77 - 86 |
Evaluation of equations of state applicable to polymers and complex systems Kang JW, Lee JH, Yoo KP, Lee CS |
87 - 96 |
Recent advances in the use of the SAFT approach in describing electrolytes, interfaces, liquid crystals and polymers Paricaud P, Galindo A, Jackson G |
97 - 106 |
Molecular thermodynamics concerning complex materials Hu Y, Liu HL, Wang WC |
107 - 122 |
The role of ion-aggregate formation in the calculation of physical properties of electrolyte solutions Barthel J, Krienke H, Neueder R, Holovko MF |
123 - 142 |
Electrolyte solutions: from thermodynamic and transport property models to the simulation of industrial processes Anderko A, Wang PM, Rafal M |
143 - 151 |
Mechanisms of gas hydrate formation and inhibition Koh CA, Westacott RE, Zhang W, Hirachand K, Creek JL, Soper AK |
153 - 160 |
Chemical modification of rutile TiO2(110) surface by ab initio calculations for the purpose of CO2 adsorption Takahashi H, Yuki K, Nitta T |
161 - 168 |
Optimized step potential models for n-alkanes and benzene Elliott JR |
169 - 183 |
Global optimization for clusters of flexible molecules -solvent-solute interaction energy calculations Cheung A, Adjiman CS, Kolar P, Ishikawa T |
185 - 196 |
Thermodynamic properties of freely-jointed hard-sphere multi-Yukawa chain fluids: theory and simulation McCabe C, Kalyuzhnyi YV, Cummings PT |
197 - 206 |
Equilibria between solid, liquid, and vapor phases in binary Lennard-Jones mixtures Lamm MH, Hall CK |
207 - 217 |
Monte Carlo simulation on the free energy of homogeneous nucleation in the supersaturated Lennard-Jones vapor phase Kataoka Y, Yamada Y |
219 - 226 |
Free-energy calculations for fluid and solid phases by molecular simulation Lu ND, Barnes CD, Kofke DA |
227 - 231 |
Molecular simulation of liquid-crystal transitions in hard prolate ellipsoid monomers and dimers Wu GW, Sadus RJ |
233 - 247 |
Micellar behavior in supercritical solvent-surfactant systems from lattice Monte Carlo simulations Lisal M, Hall CK, Gubbins KE, Panagiotopoulos AZ |
249 - 256 |
UB association bias algorithm applied to the simulation of hydrogen fluoride Wierzchowski S, Kofke DA |
257 - 270 |
Molecular dynamics study on ionic hydration Zhou J, Lu XH, Wang YR, Shi J |
271 - 280 |
Phase behavior and physico-chemical properties of aqueous electrolyte solutions near the critical point via molecular dynamics simulation with gravity perturbation Honma T, Kuzuhara S, Liew CC, Inomata H |
281 - 287 |
Density functional theory and Monte Carlo simulation of mixtures of hard sphere chains confined in a slit Cai J, Liu HL, Hu Y |
289 - 295 |
Methane adsorption in single-walled carbon nanotubes arrays by molecular simulation and density functional theory Zhang XR, Wang WC |
297 - 307 |
Simulation for separation of hydrogen and carbon monoxide by adsorption on single-walled carbon nanotubes Gu C, Gao GH, Yu YX, Nitta T |
309 - 317 |
Non-equilibrium molecular dynamics simulation study of the behavior of hydrocarbon-isomers in silicalite Furukawa S, McCabe C, Nitta T, Cummings PT |
319 - 326 |
Non-equilibrium molecular simulation studies on gas separation by microporous membranes using dual ensemble molecular simulation techniques Kobayashi Y, Takami S, Kubo M, Miyamoto A |
327 - 335 |
Web-based technologies for teaching and using molecular simulation Kofke DA, Mihalick BC |
337 - 351 |
Remarks on computing the density of dense fluids by Aalto-Keskinen model Pokki JP, Aalto M, Keskinen KI |
353 - 360 |
The impact of liquid-liquid-vapour phase behaviour on coke formation from model coke precursors Minicucci D, Zou XY, Shaw JM |
361 - 370 |
Use of a predictive electrolyte equation of state for the calculation of the gas hydrate formation temperature in the case of systems with methanol and salts Vu VQ, Suchaux PD, Furst W |
371 - 383 |
The next generation of hydrate prediction I. Hydrate standard states and incorporation of spectroscopy Ballard AL, Sloan ED |
385 - 399 |
A versatile liquid activity model for SRK, PR and a new cubic equation-of-state TST Twu CH, Sim WD, Tassone V |
401 - 409 |
An empirical near-critical correction for cubic and non-cubic equations of state Kedge CJ, Trebble MA |
411 - 437 |
Phase stability analysis with cubic equations of state by using a global optimization method Nichita DV, Gomez S, Luna E |
439 - 449 |
Evolution of equations of state through contact transformations Benayoun L, Valentin P |
451 - 467 |
Calculation of the cloud-point and the spinodal curve for the system methylcyclohexane/polystyrene at high pressures Browarzik D, Kowalewski M |
469 - 482 |
Correlation of the solubility of low-volatile organic compounds in near and supercritical fluids Part II. Applications to Disperse Red 60 and two disubstituted anthraquinones Kraska T, Leonhard KO, Tuma D, Schneider GM |
483 - 491 |
Correlation of solid solubility for biological compounds in supercritical carbon dioxide: comparative study using solution model and other approaches Cheng JS, Tang M, Chen YP |
493 - 499 |
Gas-liquid reactions under supercritical conditions - phase equilibria and thermodynamic modeling Pereda S, Bottini SB, Brignole EA |
501 - 509 |
Study of the high pressure phase behaviour of CO2+n-alkane mixtures using the SAFT-VR approach with transferable parameters Blas FJ, Galindo A |
511 - 519 |
Modeling bubble points of mixtures of hydrofluorocarbon refrigerants and polyol ester lubricants Huber ML, Lemmon EW, Friend DG |
521 - 530 |
A SAFT-DFT approach for the vapour-liquid interface of associating fluids Gloor GJ, Blas FJ, del Rio EM, de Miguel E, Jackson G |
531 - 539 |
Improving the SAFT-EOS by using an effective WCA segment diameter Ndiaye PM, Dariva C, Oliveira JV, Tavares FW |
541 - 551 |
Modeling of polymer phase equilibria using Perturbed-Chain SAFT Tumakaka F, Gross J, Sadowski G |
553 - 565 |
Phase behavior of PVAC-PTAN block copolymer in supercritical carbon dioxide using SAFT Colina CM, Hall CK, Gubbins KE |
567 - 577 |
Fluid-solid equilibria of chain-like molecules Elvassore N, Prausnitz JM |
579 - 586 |
Equation of state based on the thermodynamic perturbation theory of sequential polymerization for associating molecules and polymers Yeom MS, Chang J, Kim H |
587 - 598 |
Thermodynamic modeling of high-pressure equilibria within the McMillan-Mayer framework Elvassore N, Striolo A, Bertucco A |
599 - 607 |
High pressure phase equilibrium calculations for hydrocarbon systems using an equation of state based on the lattice fluid theory Mattedi S, Tavares FW, Castier M |
609 - 617 |
Extended hydrogen-bonding lattice fluid theory for dimers and n-mers Park BH, Kang JW, Yoo KP, Lee CS |
619 - 639 |
Applications of the group-contribution, lattice-fluid equation of state Danner RP, Hamedi M, Lee BC |
641 - 652 |
Infinite dilution activity coefficients of n-alkane solutes, butane to decane, in n-alkane solvents, heptane to hexatriacontane Kato S, Hoshino D, Noritomi H, Nagahama K |
653 - 662 |
Determination of ASOG parameters for selecting azeotropic mixtures containing hydrofluoroethers Tochigi K, Yoshida K, Kurihara K, Ochi K, Murata J, Urata S, Otake K |
663 - 673 |
Phase equilibria for complex polymer solutions Lindvig T, Hestkjaer LL, Hansen AF, Michelsen ML, Kontogeorgis GM |
675 - 688 |
Phase behavior of dendritic polymer/polar solvent: the effects of compressibility, architecture and hydrogen bondings Jang JG, Huh JY, Bae YC |
689 - 700 |
Phase equilibria in a system of "breathing" molecules Wu JZ, Prausnitz J |
701 - 715 |
Modified solvation model for salt effect on vapor-liquid equilibria Takamatsu H, Ohe S |
717 - 728 |
Phase equilibria modeling in aqueous systems containing 2-propanol and calcium chloride or/and magnesium chloride Balaban A, Kuranov G, Smirnova N |
729 - 738 |
Representation of VLE and liquid phase composition with an electrolyte model: application to H3PO4-H2O and H2SO4-H2O Cherif M, Mgaidi A, Ammar MN, Abderrabba M, Furst W |
739 - 753 |
Thermodynamics of carbohydrate surfactant containing systems Kahl H, Enders S |
755 - 769 |
Application of density functional theory for predicting the surface tension of pure polar and associating fluids Lu JF, Fu D, Liu JC, Li YG |
771 - 782 |
Solvent selection for pharmaceuticals Kolar P, Shen JW, Tsuboi A, Ishikawa T |
783 - 803 |
Conceptual design and analysis methodology for crystallization processes with electrolyte systems Takano K, Gani R, Ishikawa T, Kolar P |
805 - 815 |
Thermodynamic modeling of biomass conversion processes Zhong CL, Peters CJ, Arons JD |
817 - 824 |
Heat capacity of liquids: a survey and data needs Zabransky M, Ruzicka V |
825 - 830 |
Solubility of propane in aqueous alkanolamine solutions Jou FY, Ng HJ, Critchfield JE, Mather AE |
831 - 846 |
Phase equilibria of (methane-long chain ester cuts) systems in drilling conditions Bureau N, Defiolle D, de Hemptinne JC |
847 - 858 |
Solubility of carbon dioxide in PPO and PPO/PS blends Sato Y, Takikawa T, Yamane M, Takishima S, Masuoka H |
859 - 868 |
High-pressure NMR studies on solvation structure in supercritical carbon dioxide Kanakubo M, Umecky T, Liew CC, Aizawa T, Hatakeda K, Ikushima Y |
869 - 877 |
Temperature dependence of dielectric spectra of carbon dioxide and methanol mixtures at high-pressures Smith RL, Saito C, Suzuki S, Lee SB, Inomata H, Arai K |
879 - 884 |
Producing antioxidant fractions from herbaceous matrices by supercritical fluid extraction Yepez B, Espinosa M, Lopez S, Bolanos G |
885 - 894 |
Extraction of cocoa butter from Brazilian cocoa beans using supercritical CO2 and ethane Saldana MDA, Mohamed RS, Mazzafera P |
895 - 904 |
Measurement and correlation of solubilities of azo dyes and anthraquinone in supercritical carbon dioxide Mishima K, Matsuyama K, Ishikawa H, Hayashi K, Maeda S |
905 - 917 |
Phase equilibria for the CO2 plus methanol plus sulfathiazole system at high pressure Kordikowski A, Siddiqi M, Palakodaty S |
919 - 928 |
Measurement and correlation of excess molar enthalpies for the systems containing supercritical carbon dioxide and alcohols Ochi K, Dai WB, Wada Y, Hayashi H, Kurihara K, Kojima K |
929 - 935 |
Enthalpies of solution of carbon dioxide in mixed solvents Schafer B, Mather AE, Marsh KN |
937 - 945 |
Measurement and correlation of infinite dilution activity coefficients of alkanol or ether in aqueous solution Fukuchi K, Miyoshi K, Watanabe T, Yonezawa S, Arai Y |
947 - 956 |
Phase equilibria of carbohydrates: the study of a series of glucose oligomers from glucose to maltopentaose in aqueous solution - Experimental versus predicted data using various UNIQUAC/UNIFAC models Cooke SA, Jonsdottir SO, Westh P |
957 - 968 |
Phase equilibria in the systems 3-methylpentane plus methylcyclohexane, diisopropyl ether plus methylcyclohexane and 3-methylpentane plus diisopropyl ether plus methylcyclohexane at 101.3 kPa Loras S, Aucejo A, Munoz R |
969 - 979 |
Vapor-liquid equilibria for 1,1,2,3,3,3-hexafluoropropyl, 2,2,2-trifluoroethyl ether with several organic solvents Hiaki T, Nanao M, Urata S, Murata J |
981 - 993 |
High pressure vapor-liquid equilibria of binary mixtures composed of HFC-32, 125, 134a, 143a, 152a, 227ea and R600a (isobutane) Park JY, Lim JS, Lee BG |
995 - 1008 |
Critical locus and vapor-liquid equilibria of HFC32-HFC125 system Kato R, Shirakawa K, Nishiumi H |
1009 - 1028 |
Complex phase equilibrium phenomena in fluid ternary mixtures up to 100 MPa: cosolvency, holes, windows, and islands - review and new results Scheidgen AL, Schneider GM |
1029 - 1044 |
Two- and three-liquid phase equilibria in the system water plus 2-heptanone plus caprolactam plus ammonium sulfate: experiments and modeling van Bochove GH, Krooshof GJP, de Loos TW |
1045 - 1057 |
Retardation of asphaltene precipitation by addition of toluene, resins, deasphalted oil and surfactants Al-Sahhaf TA, Fahim MA, Elkilani AS |
1059 - 1066 |
Phase separation of polyethylene oxide (PEO)-water solution and its relationship to the flocculating capability of the PEO Pang P, Englezos P |
1067 - 1075 |
Vapor-liquid equilibria for mixed solvents-polymer systems, measurement and correlation Liu HL, Huang YM, Wang K, Hu Y |
1077 - 1087 |
Critical micelle concentration and phase behavior of aqueous mixtures of dodecylsulfates and sodium ethoxydodecylsulfate Mokrushina L, Churyusova T, Savchuk K, Morozova Y, Smirnova N |
1089 - 1095 |
Phase equilibria of water and ionic liquids [emim][PF6] and [bmim][PF6] Wong DSH, Chen JP, Chang JM, Chou CH |
1097 - 1106 |
Flow-through electrochemical cell for pH measurement of organic acid aqueous solutions at subcritical and supercritical conditions Sue K, Murata K, Matsuura Y, Tsukagoshi M, Adschiri T, Arai K |
1107 - 1117 |
Determination of solid-liquid phase equilibria by using measured DSC curves Takiyama H, Suzuki H, Uchida H, Matsuoka M |
1119 - 1129 |
Solid-liquid phase equilibria in binary (1-octanol plus n-alkane) mixtures under high pressure - Part 1. (1-octanol plus n-tetradecane or n-hexadecane) systems Yang M, Terakawa E, Tanaka Y, Sotani T, Matsuo S |
1131 - 1140 |
Role of attractive forces in self-diffusion and mutual diffusion in dense simple fluids and real substances Coelho LAF, de Oliveira JV, Tavares FW, Matthews MA |
1141 - 1159 |
Prediction of diffusion coefficients for gas, liquid and supercritical fluid: application to pure real fluids and infinite dilute binary solutions based on the simulation of Lennard-Jones fluid Zhu Y, Lu XH, Zhou J, Wang YR, Shi J |
1161 - 1167 |
Concentration dependence of diffusion coefficients for supercritical carbon dioxide plus naphthalene system Higashi H, Iwai Y, Oda T, Nakamura Y, Arai Y |
1169 - 1178 |
Measurements of binary diffusion coefficients for some low volatile compounds in supercritical carbon dioxide by input-output response technique with two diffusion columns connected in series Funazukuri T, Kong CY, Kagei S |
1179 - 1189 |
Activity coefficients and diffusivities of solvents in polymers Zhang SJ, Tsuboi A, Nakata H, Ishikawa T |
1191 - 1203 |
Viscosity modeling of associating fluids based on the friction theory: pure alcohols Zeberg-Mikkelsen CK, Quinones-Cisneros SE, Stenby EH |
1205 - 1213 |
Experimental study on the transport properties of fluorinated ethers Matsuo S, Tanaka Y, Sotani T |