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Results: 1-20 |
Results: 20
INTERPLAY BETWEEN MOLECULAR SIMULATION AND NEUTRON-SCATTERING IN DEVELOPING NEW INSIGHTS INTO THE STRUCTURE OF WATER
Authors: CHIALVO AA CUMMINGS PT SIMONSON JM MESMER RE COCHRAN HD
Citation: Aa. Chialvo et al., INTERPLAY BETWEEN MOLECULAR SIMULATION AND NEUTRON-SCATTERING IN DEVELOPING NEW INSIGHTS INTO THE STRUCTURE OF WATER, Industrial & engineering chemistry research, 37(8), 1998, pp. 3021-3025
SIMPLE TRANSFERABLE INTERMOLECULAR POTENTIAL FOR THE MOLECULAR SIMULATION OF WATER OVER WIDE RANGES OF STATE CONDITIONS
Authors: CHIALVO AA CUMMINGS PT
Citation: Aa. Chialvo et Pt. Cummings, SIMPLE TRANSFERABLE INTERMOLECULAR POTENTIAL FOR THE MOLECULAR SIMULATION OF WATER OVER WIDE RANGES OF STATE CONDITIONS, Fluid phase equilibria, 151, 1998, pp. 73-81
THERMODYNAMICS AND KINETICS OF ION SPECIATION IN SUPERCRITICAL AQUEOUS-SOLUTIONS - A MOLECULAR-BASED STUDY
Authors: CHIALVO AA CUMMINGS PT SIMONSON JM MESMER RE
Citation: Aa. Chialvo et al., THERMODYNAMICS AND KINETICS OF ION SPECIATION IN SUPERCRITICAL AQUEOUS-SOLUTIONS - A MOLECULAR-BASED STUDY, Fluid phase equilibria, 151, 1998, pp. 107-115
SOLVATION EFFECT ON KINETIC RATE-CONSTANT OF REACTIONS IN SUPERCRITICAL SOLVENTS
Authors: CHIALVO AA CUMMINGS PT KALYUZHNYI YV
Citation: Aa. Chialvo et al., SOLVATION EFFECT ON KINETIC RATE-CONSTANT OF REACTIONS IN SUPERCRITICAL SOLVENTS, AIChE journal, 44(3), 1998, pp. 667-680
MOLECULAR SIMULATION STUDY OF SPECIATION IN SUPERCRITICAL AQUEOUS NACL SOLUTIONS
Authors: CHIALVO AA CUMMINGS PT SIMONSON JM MESMER RE
Citation: Aa. Chialvo et al., MOLECULAR SIMULATION STUDY OF SPECIATION IN SUPERCRITICAL AQUEOUS NACL SOLUTIONS, Journal of molecular liquids, 73-4, 1997, pp. 361-372
MOLECULAR SIMULATION OF SUPERCRITICAL WATER AND AQUEOUS-SOLUTIONS
Authors: CUMMINGS PT CHIALVO AA
Citation: Pt. Cummings et Aa. Chialvo, MOLECULAR SIMULATION OF SUPERCRITICAL WATER AND AQUEOUS-SOLUTIONS, Journal of physics. Condensed matter, 8(47), 1996, pp. 9281-9287
SOLVATION STRUCTURE, HYDROGEN-BONDING, AND ION-PAIRING IN DILUTE SUPERCRITICAL AQUEOUS NACL MIXTURES
Authors: CHIALVO AA CUMMINGS PT COCHRAN HD
Citation: Aa. Chialvo et al., SOLVATION STRUCTURE, HYDROGEN-BONDING, AND ION-PAIRING IN DILUTE SUPERCRITICAL AQUEOUS NACL MIXTURES, International journal of thermophysics, 17(1), 1996, pp. 147-156
MICROSTRUCTURE OF AMBIENT AND SUPERCRITICAL WATER - DIRECT COMPARISONBETWEEN SIMULATION AND NEUTRON-SCATTERING EXPERIMENTS
Authors: CHIALVO AA CUMMINGS PT
Citation: Aa. Chialvo et Pt. Cummings, MICROSTRUCTURE OF AMBIENT AND SUPERCRITICAL WATER - DIRECT COMPARISONBETWEEN SIMULATION AND NEUTRON-SCATTERING EXPERIMENTS, Journal of physical chemistry, 100(4), 1996, pp. 1309-1316
TEMPERATURE AND DENSITY EFFECTS ON THE HIGH-TEMPERATURE IONIC SPECIATION IN DILUTE NA+ CL- AQUEOUS-SOLUTIONS/
Authors: CHIALVO AA CUMMINGS PT SIMONSON JM MESMER RE
Citation: Aa. Chialvo et al., TEMPERATURE AND DENSITY EFFECTS ON THE HIGH-TEMPERATURE IONIC SPECIATION IN DILUTE NA+ CL- AQUEOUS-SOLUTIONS/, The Journal of chemical physics, 105(20), 1996, pp. 9248-9257
ENGINEERING A SIMPLE POLARIZABLE MODEL FOR THE MOLECULAR SIMULATION OF WATER APPLICABLE OVER WIDE RANGES OF STATE CONDITIONS
Authors: CHIALVO AA CUMMINGS PT
Citation: Aa. Chialvo et Pt. Cummings, ENGINEERING A SIMPLE POLARIZABLE MODEL FOR THE MOLECULAR SIMULATION OF WATER APPLICABLE OVER WIDE RANGES OF STATE CONDITIONS, The Journal of chemical physics, 105(18), 1996, pp. 8274-8281
ON THE REALISM OF THE RE-ENGINEERED SIMPLE POINT-CHARGE WATER MODEL
Authors: CHIALVO AA
Citation: Aa. Chialvo, ON THE REALISM OF THE RE-ENGINEERED SIMPLE POINT-CHARGE WATER MODEL, The Journal of chemical physics, 104(13), 1996, pp. 5240-5243
SOLVATION THERMODYNAMICS OF GAS SOLUBILITY AT SUB-CRITICAL AND NEAR-CRITICAL CONDITIONS
Authors: CHIALVO AA KALYUZHNYI YV CUMMINGS PT
Citation: Aa. Chialvo et al., SOLVATION THERMODYNAMICS OF GAS SOLUBILITY AT SUB-CRITICAL AND NEAR-CRITICAL CONDITIONS, AIChE journal, 42(2), 1996, pp. 571-584
NEAR-CRITICAL PHASE-BEHAVIOR OF DILUTE MIXTURES - COMMENT
Authors: CHIALVO AA CUMMINGS PT
Citation: Aa. Chialvo et Pt. Cummings, NEAR-CRITICAL PHASE-BEHAVIOR OF DILUTE MIXTURES - COMMENT, Molecular physics, 84(1), 1995, pp. 41-48
NA-CL- ION-PAIR ASSOCIATION IN SUPERCRITICAL WATER()
Authors: CHIALVO AA CUMMINGS PT COCHRAN HD SIMONSON JM MESMER RE
Citation: Aa. Chialvo et al., NA-CL- ION-PAIR ASSOCIATION IN SUPERCRITICAL WATER(), The Journal of chemical physics, 103(21), 1995, pp. 9379-9387
HYDROGEN-BONDING IN SUPERCRITICAL WATER
Authors: CHIALVO AA CUMMINGS PT
Citation: Aa. Chialvo et Pt. Cummings, HYDROGEN-BONDING IN SUPERCRITICAL WATER, The Journal of chemical physics, 101(5), 1994, pp. 4466-4469
MOLECULAR SIMULATION STUDY OF SOLVATION STRUCTURE IN SUPERCRITICAL AQUEOUS-SOLUTIONS
Authors: CUMMINGS PT CHIALVO AA COCHRAN HD
Citation: Pt. Cummings et al., MOLECULAR SIMULATION STUDY OF SOLVATION STRUCTURE IN SUPERCRITICAL AQUEOUS-SOLUTIONS, Chemical Engineering Science, 49(17), 1994, pp. 2735-2748
SOLUTE-INDUCED EFFECTS ON THE STRUCTURE AND THERMODYNAMICS OF INFINITELY DILUTE MIXTURES
Authors: CHIALVO AA CUMMINGS PT
Citation: Aa. Chialvo et Pt. Cummings, SOLUTE-INDUCED EFFECTS ON THE STRUCTURE AND THERMODYNAMICS OF INFINITELY DILUTE MIXTURES, AIChE journal, 40(9), 1994, pp. 1558-1573
RELATIONSHIP BETWEEN MCQUARRIE AND HELFAND EQUATIONS FOR THE DETERMINATION OF SHEAR VISCOSITY FROM EQUILIBRIUM MOLECULAR-DYNAMICS
Authors: CHIALVO AA CUMMINGS PT EVANS DJ
Citation: Aa. Chialvo et al., RELATIONSHIP BETWEEN MCQUARRIE AND HELFAND EQUATIONS FOR THE DETERMINATION OF SHEAR VISCOSITY FROM EQUILIBRIUM MOLECULAR-DYNAMICS, Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics, 47(3), 1993, pp. 1702-1711
STRUCTURE OF MIXED-SOLVENT ELECTROLYTE-SOLUTIONS VIA GIBBS ENSEMBLE MONTE-CARLO SIMULATION
Authors: CHIALVO AA CUMMINGS PT
Citation: Aa. Chialvo et Pt. Cummings, STRUCTURE OF MIXED-SOLVENT ELECTROLYTE-SOLUTIONS VIA GIBBS ENSEMBLE MONTE-CARLO SIMULATION, Molecular simulation, 11(2-4), 1993, pp. 163-175
ACCURATE CALCULATION OF EXCESS THERMAL, INFINITE DILUTION, AND RELATED PROPERTIES OF LIQUID-MIXTURES VIA MOLECULAR-BASED SIMULATION
Authors: CHIALVO AA
Citation: Aa. Chialvo, ACCURATE CALCULATION OF EXCESS THERMAL, INFINITE DILUTION, AND RELATED PROPERTIES OF LIQUID-MIXTURES VIA MOLECULAR-BASED SIMULATION, Fluid phase equilibria, 83, 1993, pp. 23-32
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