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Results: 1-25 | 26-32
Results: 1-25/32
TRANSFERABLE POTENTIALS FOR PHASE-EQUILIBRIA - 1 - UNITED-ATOM DESCRIPTION OF N-ALKANES
Authors: MARTIN MG SIEPMANN JI
Citation: Mg. Martin et Ji. Siepmann, TRANSFERABLE POTENTIALS FOR PHASE-EQUILIBRIA - 1 - UNITED-ATOM DESCRIPTION OF N-ALKANES, JOURNAL OF PHYSICAL CHEMISTRY B, 102(14), 1998, pp. 2569-2577
THERMODYNAMIC PROPERTIES OF THE WILLIAMS, OPLS-AA, AND MMFF94 ALL-ATOM FORCE-FIELDS FOR NORMAL-ALKANES
Authors: CHEN B MARTIN MG SIEPMANN JI
Citation: B. Chen et al., THERMODYNAMIC PROPERTIES OF THE WILLIAMS, OPLS-AA, AND MMFF94 ALL-ATOM FORCE-FIELDS FOR NORMAL-ALKANES, JOURNAL OF PHYSICAL CHEMISTRY B, 102(14), 1998, pp. 2578-2586
CALCULATING GIBBS FREE-ENERGIES OF TRANSFER FROM GIBBS ENSEMBLE MONTE-CARLO SIMULATIONS
Authors: MARTIN MG SIEPMANN JI
Citation: Mg. Martin et Ji. Siepmann, CALCULATING GIBBS FREE-ENERGIES OF TRANSFER FROM GIBBS ENSEMBLE MONTE-CARLO SIMULATIONS, Theoretical Chemistry accounts ( Theoretical Chemistry accounts (Print)), 99(5), 1998, pp. 347-350
INTERMOLECULAR POTENTIALS AND VAPOR-LIQUID PHASE-EQUILIBRIA OF PERFLUORINATED ALKANES
Authors: CUI ST SIEPMANN JI COCHRAN HD CUMMINGS PT
Citation: St. Cui et al., INTERMOLECULAR POTENTIALS AND VAPOR-LIQUID PHASE-EQUILIBRIA OF PERFLUORINATED ALKANES, Fluid phase equilibria, 146(1-2), 1998, pp. 51-61
IMPROVING THE EFFICIENCY OF THE CONFIGURATIONAL-BIAS MONTE-CARLO ALGORITHM
Authors: VLUGT TJH MARTIN MG SMIT B SIEPMANN JI KRISHNA R
Citation: Tjh. Vlugt et al., IMPROVING THE EFFICIENCY OF THE CONFIGURATIONAL-BIAS MONTE-CARLO ALGORITHM, Molecular physics, 94(4), 1998, pp. 727-733
COMPUTER-SIMULATIONS OF VAPOR-LIQUID PHASE-EQUILIBRIA OF N-ALKANES (VOL 102, PG 2126, 1995)
Authors: SMIT B KARABORNI S SIEPMANN JI
Citation: B. Smit et al., COMPUTER-SIMULATIONS OF VAPOR-LIQUID PHASE-EQUILIBRIA OF N-ALKANES (VOL 102, PG 2126, 1995), The Journal of chemical physics, 109(1), 1998, pp. 352-352
A NOVEL MONTE-CARLO ALGORITHM FOR POLARIZABLE FORCE-FIELDS - APPLICATION TO A FLUCTUATING CHARGE MODEL FOR WATER
Authors: MARTIN MG CHEN B SIEPMANN JI
Citation: Mg. Martin et al., A NOVEL MONTE-CARLO ALGORITHM FOR POLARIZABLE FORCE-FIELDS - APPLICATION TO A FLUCTUATING CHARGE MODEL FOR WATER, The Journal of chemical physics, 108(9), 1998, pp. 3383-3385
EXPLORATION OF THE VAPOR-LIQUID PHASE-EQUILIBRIA AND CRITICAL-POINTS OF TRIACONTANE ISOMERS
Authors: ZHURAVLEV ND SIEPMANN JI
Citation: Nd. Zhuravlev et Ji. Siepmann, EXPLORATION OF THE VAPOR-LIQUID PHASE-EQUILIBRIA AND CRITICAL-POINTS OF TRIACONTANE ISOMERS, Fluid phase equilibria, 134(1-2), 1997, pp. 55-61
INTERMOLECULAR POTENTIALS FOR BRANCHED ALKANES AND THE VAPOR-LIQUID PHASE-EQUILIBRIA OF N-HEPTANE, 2-METHYLHEXANE, AND 3-ETHYLPENTANE
Authors: SIEPMANN JI MARTIN MG MUNDY CJ KLEIN ML
Citation: Ji. Siepmann et al., INTERMOLECULAR POTENTIALS FOR BRANCHED ALKANES AND THE VAPOR-LIQUID PHASE-EQUILIBRIA OF N-HEPTANE, 2-METHYLHEXANE, AND 3-ETHYLPENTANE, Molecular physics, 90(5), 1997, pp. 687-693
HIGH-RESOLUTION C-13 AND H-1 SOLUTION NMR-STUDY OF POLY(LACTIDE)
Authors: THAKUR KAM KEAN RT HALL ES KOLSTAD JJ LINDGREN TA DOSCOTCH MA SIEPMANN JI MUNSON EJ
Citation: Kam. Thakur et al., HIGH-RESOLUTION C-13 AND H-1 SOLUTION NMR-STUDY OF POLY(LACTIDE), Macromolecules, 30(8), 1997, pp. 2422-2428
PREDICTING MULTICOMPONENT PHASE-EQUILIBRIA AND FREE-ENERGIES OF TRANSFER FOR ALKANES BY MOLECULAR SIMULATION
Authors: MARTIN MG SIEPMANN JI
Citation: Mg. Martin et Ji. Siepmann, PREDICTING MULTICOMPONENT PHASE-EQUILIBRIA AND FREE-ENERGIES OF TRANSFER FOR ALKANES BY MOLECULAR SIMULATION, Journal of the American Chemical Society, 119(38), 1997, pp. 8921-8924
EQUILIBRIUM AND NONEQUILIBRIUM SIMULATION STUDIES OF FLUID ALKANES INBULK AND AT INTERFACES
Authors: MUNDY CJ BALASUBRAMANIAN S BAGCHI K SIEPMANN JI KLEIN ML
Citation: Cj. Mundy et al., EQUILIBRIUM AND NONEQUILIBRIUM SIMULATION STUDIES OF FLUID ALKANES INBULK AND AT INTERFACES, Faraday discussions, (104), 1996, pp. 17-36
DETERMINATION OF THE PRESSURE-VISCOSITY COEFFICIENT OF DECANE BY MOLECULAR SIMULATION
Authors: MUNDY CJ KLEIN ML SIEPMANN JI
Citation: Cj. Mundy et al., DETERMINATION OF THE PRESSURE-VISCOSITY COEFFICIENT OF DECANE BY MOLECULAR SIMULATION, Journal of physical chemistry, 100(42), 1996, pp. 16779-16781
SIMULATION STUDIES OF ULTRATHIN FILMS OF LINEAR AND BRANCHED ALKANES ON A METAL-SUBSTRATE
Authors: BALASUBRAMANIAN S KLEIN ML SIEPMANN JI
Citation: S. Balasubramanian et al., SIMULATION STUDIES OF ULTRATHIN FILMS OF LINEAR AND BRANCHED ALKANES ON A METAL-SUBSTRATE, Journal of physical chemistry, 100(29), 1996, pp. 11960-11963
DECANE UNDER SHEAR - A MOLECULAR-DYNAMICS STUDY USING REVERSIBLE NVT-SLLOD AND NPT-SLLOD ALGORITHMS (VOL 103, PG 10192, 1995)
Authors: MUNDY CJ SIEPMANN JI KLEIN ML
Citation: Cj. Mundy et al., DECANE UNDER SHEAR - A MOLECULAR-DYNAMICS STUDY USING REVERSIBLE NVT-SLLOD AND NPT-SLLOD ALGORITHMS (VOL 103, PG 10192, 1995), The Journal of chemical physics, 104(19), 1996, pp. 7797-7797
SIMULATING COMPLEX FLUIDS
Authors: ESSELINK K HILBERS PAJ KARABORNI S SIEPMANN JI SMIT B
Citation: K. Esselink et al., SIMULATING COMPLEX FLUIDS, Molecular simulation, 14(4-5), 1995, pp. 259-274
MONTE-CARLO INVESTIGATIONS OF HEXADECANE FILMS ON A METAL-SUBSTRATE
Authors: BALASUBRAMANIAN S KLEIN ML SIEPMANN JI
Citation: S. Balasubramanian et al., MONTE-CARLO INVESTIGATIONS OF HEXADECANE FILMS ON A METAL-SUBSTRATE, The Journal of chemical physics, 103(8), 1995, pp. 3184-3195
DECANE UNDER SHEAR - A MOLECULAR-DYNAMICS STUDY USING REVERSIBLE NVT-SLLOD AND NPT-SLLOD ALGORITHMS
Authors: MUNDY CJ SIEPMANN JI KLEIN ML
Citation: Cj. Mundy et al., DECANE UNDER SHEAR - A MOLECULAR-DYNAMICS STUDY USING REVERSIBLE NVT-SLLOD AND NPT-SLLOD ALGORITHMS, The Journal of chemical physics, 103(23), 1995, pp. 10192-10200
CALCULATION OF THE SHEAR VISCOSITY OF DECANE USING A REVERSIBLE MULTIPLE TIME-STEP ALGORITHM
Authors: MUNDY CJ SIEPMANN JI KLEIN ML
Citation: Cj. Mundy et al., CALCULATION OF THE SHEAR VISCOSITY OF DECANE USING A REVERSIBLE MULTIPLE TIME-STEP ALGORITHM, The Journal of chemical physics, 102(8), 1995, pp. 3376-3380
COMPUTER-SIMULATIONS OF VAPOR-LIQUID PHASE-EQUILIBRIA OF N-ALKANES
Authors: SMIT B KARABORNI S SIEPMANN JI
Citation: B. Smit et al., COMPUTER-SIMULATIONS OF VAPOR-LIQUID PHASE-EQUILIBRIA OF N-ALKANES, The Journal of chemical physics, 102(5), 1995, pp. 2126-2140
INFLUENCE OF SURFACE-TOPOLOGY AND ELECTROSTATIC POTENTIAL ON WATER ELECTRODE SYSTEMS
Authors: SIEPMANN JI SPRIK M
Citation: Ji. Siepmann et M. Sprik, INFLUENCE OF SURFACE-TOPOLOGY AND ELECTROSTATIC POTENTIAL ON WATER ELECTRODE SYSTEMS, The Journal of chemical physics, 102(1), 1995, pp. 511-524
FREE-ENERGIES AND PHASE-EQUILIBRIA OF CHAIN MOLECULES
Authors: SMIT B KARABORNI S SIEPMANN JI
Citation: B. Smit et al., FREE-ENERGIES AND PHASE-EQUILIBRIA OF CHAIN MOLECULES, Macromolecular symposia, 81, 1994, pp. 343-354
SIMULATING THE ADSORPTION OF ALKANES IN ZEOLITES
Authors: SMIT B SIEPMANN JI
Citation: B. Smit et Ji. Siepmann, SIMULATING THE ADSORPTION OF ALKANES IN ZEOLITES, Science, 264(5162), 1994, pp. 1118-1120
THE EFFECTS OF FINITE-SIZE IN MOLECULAR-DYNAMICS SIMULATIONS OF LANGMUIR MONOLAYERS
Authors: KARABORNI S SIEPMANN JI
Citation: S. Karaborni et Ji. Siepmann, THE EFFECTS OF FINITE-SIZE IN MOLECULAR-DYNAMICS SIMULATIONS OF LANGMUIR MONOLAYERS, Molecular physics, 83(2), 1994, pp. 345-350
COMPUTER-SIMULATIONS OF THE ENERGETICS AND SITING OF N-ALKANES IN ZEOLITES
Authors: SMIT B SIEPMANN JI
Citation: B. Smit et Ji. Siepmann, COMPUTER-SIMULATIONS OF THE ENERGETICS AND SITING OF N-ALKANES IN ZEOLITES, Journal of physical chemistry, 98(34), 1994, pp. 8442-8452
Risultati: 1-25 | 26-32