-
2
-
-
0004196268
-
Liquid-vapor coexistence by molecular dynamics simulation
-
Baranyai, A., and P. T. Cummings, "Liquid-Vapor Coexistence by Molecular Dynamics Simulation," J. Chem. Phys., 112, 3516 (2000).
-
(2000)
J. Chem. Phys.
, vol.112
, pp. 3516
-
-
Baranyai, A.1
Cummings, P.T.2
-
3
-
-
11944252503
-
Scaling fields and universality of the liquid-gas critical point
-
Bruce, A. D., and N. B. Wilding, "Scaling Fields and Universality of the Liquid-Gas Critical Point," Phys. Rev. Lett., 68, 193 (1992).
-
(1992)
Phys. Rev. Lett.
, vol.68
, pp. 193
-
-
Bruce, A.D.1
Wilding, N.B.2
-
5
-
-
0000378037
-
Transferable potentials for phase equilibria: 3. Explicit-hydrogen description of normal Alkanes
-
Chen, B., and J. I. Siepmann, "Transferable Potentials for Phase Equilibria: 3. Explicit-Hydrogen Description of Normal Alkanes," J. Phys. Chem. B, 103, 5370 (1999).
-
(1999)
J. Phys. Chem. B
, vol.103
, pp. 5370
-
-
Chen, B.1
Siepmann, J.I.2
-
6
-
-
0032165048
-
Critical properites for carbon dioxide + n-Alkane mixtures using a variable-volume view cell
-
Choi, E-J., and S-D. Yeo, "Critical Properites for Carbon Dioxide + n-Alkane Mixtures Using a Variable-Volume View Cell," J. Chem. Eng. Data, 43, 714 (1998).
-
(1998)
J. Chem. Eng. Data
, vol.43
, pp. 714
-
-
Choi, E.-J.1
Yeo, S.-D.2
-
7
-
-
1642358483
-
Vapor-liquid phase coexistence of Alkane-carbon dioxide and perfluoroalkane-carbon dioxide mixtures
-
Cui, S. T., H. D. Cochran, and P. T. Cummings, "Vapor-Liquid Phase Coexistence of Alkane-Carbon Dioxide and Perfluoroalkane-Carbon Dioxide Mixtures," J. Phys. Chem. B, 103, 4485 (1999).
-
(1999)
J. Phys. Chem. B
, vol.103
, pp. 4485
-
-
Cui, S.T.1
Cochran, H.D.2
Cummings, P.T.3
-
8
-
-
4243819810
-
New Monte Carlo technique for studying phase transitions
-
Ferrenberg, A. M., and R. H. Swendsen, "New Monte Carlo Technique for Studying Phase Transitions," Phys. Rev. Lett., 61, 2635 (1988).
-
(1988)
Phys. Rev. Lett.
, vol.61
, pp. 2635
-
-
Ferrenberg, A.M.1
Swendsen, R.H.2
-
9
-
-
33646987405
-
Optimized Monte Carlo data analysis
-
Ferrenberg, A. M., and R. H. Swendsen, "Optimized Monte Carlo Data Analysis," Phys. Rev. Lett., 63, 1195 (1989).
-
(1989)
Phys. Rev. Lett.
, vol.63
, pp. 1195
-
-
Ferrenberg, A.M.1
Swendsen, R.H.2
-
10
-
-
0028131052
-
Phase diagrams of diatomic molecules using the Gibbs Ensemble Monte Carlo method
-
Galassi, G., and D. J. Tildesley, "Phase Diagrams of Diatomic Molecules Using the Gibbs Ensemble Monte Carlo Method," Mol. Simp., 13, 11 (1994).
-
(1994)
Mol. Simp.
, vol.13
, pp. 11
-
-
Galassi, G.1
Tildesley, D.J.2
-
11
-
-
0003460614
-
-
Scholium International, Flushing, NY
-
Gmehling, J., and U. Onken, Vapor-Liquid Equilibrium Data Collection, Scholium International, Flushing, NY (1977).
-
(1977)
Vapor-Liquid Equilibrium Data Collection
-
-
Gmehling, J.1
Onken, U.2
-
12
-
-
84923004214
-
-
Clarendon Press, Oxford
-
Gray, C. G., and K. E. Gubbins, Theory of Molecular Fluids, Vol. 1, Fundamentals, Clarendon Press, Oxford (1984).
-
(1984)
Theory of Molecular Fluids, Vol. 1, Fundamentals
, vol.1
-
-
Gray, C.G.1
Gubbins, K.E.2
-
13
-
-
13444281787
-
Carbon dioxide's liquid-vapor coexistence curve and critical properties as predicted by a simple molecular model
-
Harris, J. G., and K. H. Yung, "Carbon Dioxide's Liquid-Vapor Coexistence Curve and Critical Properties as Predicted by a Simple Molecular Model," J. Phys. Chem. B, 99, 12021 (1995).
-
(1995)
J. Phys. Chem. B
, vol.99
, pp. 12021
-
-
Harris, J.G.1
Yung, K.H.2
-
14
-
-
0004016501
-
Comparison of simple potential functions for simulating liquid water
-
Jorgensen, W. L., J. Chandrasekhar, J. D. Madura, R. W. Impey, and M. L. Klein, "Comparison of Simple Potential Functions for Simulating Liquid Water." J. Chem. Phys., 79, 926 (1983).
-
(1983)
J. Chem. Phys.
, vol.79
, pp. 926
-
-
Jorgensen, W.L.1
Chandrasekhar, J.2
Madura, J.D.3
Impey, R.W.4
Klein, M.L.5
-
15
-
-
0004352779
-
Direct evaluation of phase coexistence by molecular simulation via integration along the saturation line
-
Kofke, D. A., "Direct Evaluation of Phase Coexistence by Molecular Simulation via Integration Along the Saturation Line," J. Chem. Phys., 98, 4199 (1992).
-
(1992)
J. Chem. Phys.
, vol.98
, pp. 4199
-
-
Kofke, D.A.1
-
16
-
-
36849098438
-
Combining rules for intermolecular potential parameters: II. Rules for the Lennard-Jones (12-6) potential and the morse potential
-
Kong, C. L., "Combining Rules for Intermolecular Potential Parameters: II. Rules for the Lennard-Jones (12-6) Potential and the Morse Potential," J. Chem. Phys., 59, 2464 (1973).
-
(1973)
J. Chem. Phys.
, vol.59
, pp. 2464
-
-
Kong, C.L.1
-
17
-
-
0000759585
-
Vapor-liquid phase equilibrium for carbon dioxide-n-hexane at 40, 80, and 120°C
-
Li, Y.-H., K. H. Dillard, and R. L. Robinson Jr., "Vapor-Liquid Phase Equilibrium for Carbon Dioxide-n-Hexane at 40, 80, and 120°C," J. Chem. Eng. Data, 26, 53 (1981).
-
(1981)
J. Chem. Eng. Data
, vol.26
, pp. 53
-
-
Li, Y.-H.1
Dillard, K.H.2
Robinson R.L., Jr.3
-
18
-
-
0000392448
-
Vapor-liquid equilibria of binary and ternary mixtures containing methane, ethane, and carbon dioxide from Gibbs ensemble simulations
-
Liu, A., and T. L. Beck, "Vapor-Liquid Equilibria of Binary and Ternary Mixtures Containing Methane, Ethane, and Carbon Dioxide from Gibbs Ensemble Simulations," J. Phys. Chem. B, 102, 7627 (1998).
-
(1998)
J. Phys. Chem. B
, vol.102
, pp. 7627
-
-
Liu, A.1
Beck, T.L.2
-
19
-
-
0003822640
-
-
Clarendon Press, Oxford
-
Maitland, G. C., M. Rigby, E. B. Smith, and W. A. Wakeham, Intermolecular Forces: Their Origin and Determination, Clarendon Press, Oxford (1981).
-
(1981)
Intermolecular Forces: Their Origin and Determination
-
-
Maitland, G.C.1
Rigby, M.2
Smith, E.B.3
Wakeham, W.A.4
-
20
-
-
0000013131
-
Novel configurational-bias Monte Carlo method for branched molecules. Transferable potentials for phase equilibria: 2. United-atom description of branched Alkanes
-
Martin, M. G., and J. I. Siepmann, "Novel Configurational-Bias Monte Carlo Method for Branched Molecules. Transferable Potentials for Phase Equilibria: 2. United-Atom Description of Branched Alkanes," J. Phys. Chem. B, 103, 973 (1999).
-
(1999)
J. Phys. Chem. B
, vol.103
, pp. 973
-
-
Martin, M.G.1
Siepmann, J.I.2
-
21
-
-
0034095008
-
Microencapsulation of proteins by rapid expansion of supercritical solution with a nonsolvent
-
Mishima, K., K. Matsuyama, D. Tanabe, S. Yamauchi, T. J. Young, and K. P. Johnston, "Microencapsulation of Proteins by Rapid Expansion of Supercritical Solution with a Nonsolvent," AIChE J., 46, 857 (2000).
-
(2000)
AIChE J.
, vol.46
, pp. 857
-
-
Mishima, K.1
Matsuyama, K.2
Tanabe, D.3
Yamauchi, S.4
Young, T.J.5
Johnston, K.P.6
-
22
-
-
0017949434
-
Critical points of mixtures: An analogy with pure fluids
-
Moldover, R. M., and J. S. Gallagher, "Critical Points of Mixtures: An Analogy with Pure Fluids," AICHE J., 24, 267 (1978).
-
(1978)
AICHE J.
, vol.24
, pp. 267
-
-
Moldover, R.M.1
Gallagher, J.S.2
-
23
-
-
84946342784
-
Electrostatic interactions in molecular crystals. Lattice dynamics of solid nitrogen and carbon dioxide
-
Murthy, C. S., S. F. O'Shea, and I. R. McDonald, "Electrostatic Interactions in Molecular Crystals. Lattice Dynamics of Solid Nitrogen and Carbon Dioxide," Molec. Phys. 50, 531 (1983).
-
(1983)
Molec. Phys.
, vol.50
, pp. 531
-
-
Murthy, C.S.1
O'Shea, S.F.2
McDonald, I.R.3
-
24
-
-
0000733554
-
Critical locus, (vapor + liquid) equilibria, and coexisting densities of (carbon dioxide + propane) at temperatures from 311 K to 361 K
-
Niesen, V. G., and J. C. Rainwater, "Critical Locus, (Vapor + Liquid) Equilibria, and Coexisting Densities of (Carbon Dioxide + Propane) at Temperatures from 311 K to 361 K," J. Chem. Thermodyn., 22, 777 (1990).
-
(1990)
J. Chem. Thermodyn.
, vol.22
, pp. 777
-
-
Niesen, V.G.1
Rainwater, J.C.2
-
25
-
-
0037863789
-
-
NIST Chemistry WebBook, available on the Web at http://webbook.nist.gov/chemistry/(2000).
-
-
-
-
26
-
-
84907891355
-
Direct determination of phase coexistence properties of fluids by Monte Carlo simulation in a new ensemble
-
Panagiotopoulos, A. Z., "Direct Determination of Phase Coexistence Properties of Fluids by Monte Carlo Simulation in a New Ensemble," Molec. Phys., 61, 813 (1987).
-
(1987)
Molec. Phys.
, vol.61
, pp. 813
-
-
Panagiotopoulos, A.Z.1
-
27
-
-
3943092257
-
Phase equlibria by simulation in the Gibbs ensemble. Alternative derivation, generalization and application to mixture and membrane equilibria
-
Panagiotopoulos, A. Z., N. Quirke, M. Stapleton, and D. J. Tildesley, "Phase Equlibria by Simulation in the Gibbs Ensemble. Alternative Derivation, Generalization and Application to Mixture and Membrane Equilibria," Mol. Phys., 63, 527 (1988).
-
(1988)
Mol. Phys.
, vol.63
, pp. 527
-
-
Panagiotopoulos, A.Z.1
Quirke, N.2
Stapleton, M.3
Tildesley, D.J.4
-
28
-
-
0000943447
-
Critical point and phase behavior of the pure fluid and a Lennard-Jones mixture
-
Potoff, J. J., and A. Z. Panagiotopoulos, "Critical Point and Phase Behavior of the Pure Fluid and a Lennard-Jones Mixture," J. Chem. Phys., 109, 10914 (1998).
-
(1998)
J. Chem. Phys.
, vol.109
, pp. 10914
-
-
Potoff, J.J.1
Panagiotopoulos, A.Z.2
-
29
-
-
0001660972
-
Molecular simulation of phase equilibria for mixtures of polar and non-polar components
-
Potoff, J. J, J. R. Errington, and A. Z. Panagiotopoulos, "Molecular Simulation of Phase Equilibria for Mixtures of Polar and Non-Polar Components," Mol. Phys., 97, 1073 (1999).
-
(1999)
Mol. Phys.
, vol.97
, pp. 1073
-
-
Potoff, J.J.1
Errington, J.R.2
Panagiotopoulos, A.Z.3
-
30
-
-
0004196270
-
-
T. J. Bruno and J. F. Ely, eds., CRC Press, Ann Arbor, MI
-
Rainwater, J. C., Supercritical Fluid Science and Technology, T. J. Bruno and J. F. Ely, eds., CRC Press, Ann Arbor, MI (1991).
-
(1991)
Supercritical Fluid Science and Technology
-
-
Rainwater, J.C.1
-
31
-
-
0000162544
-
Phase equilibria in hydrocarbon systems: Volumetric phase behavior of the propane-carbon dioxide system
-
Reamer, H. H., B. H. Sage, and W. N. Lacey, "Phase Equilibria in Hydrocarbon Systems: Volumetric Phase Behavior of the Propane-Carbon Dioxide System," Ind. Eng. Chem., 43, 2515 (1951).
-
(1951)
Ind. Eng. Chem.
, vol.43
, pp. 2515
-
-
Reamer, H.H.1
Sage, B.H.2
Lacey, W.N.3
-
32
-
-
0003517855
-
-
McGraw-Hill, New York
-
Reid, R. C., J. M. Prausnitz, and T. K. Sherwood, The Properties of Gases and Liquids, McGraw-Hill, New York (1977).
-
(1977)
The Properties of Gases and Liquids
-
-
Reid, R.C.1
Prausnitz, J.M.2
Sherwood, T.K.3
-
34
-
-
0000366719
-
Critcal-point and coexistence-curve properties of the Lennard-Jones fluid: A finite-size scaling study
-
Wilding, N. B., "Critcal-Point and Coexistence-Curve Properties of the Lennard-Jones Fluid: A Finite-Size Scaling Study," Phys. Rev. E, 52, 602 (1995).
-
(1995)
Phys. Rev. E
, vol.52
, pp. 602
-
-
Wilding, N.B.1
-
35
-
-
0032669341
-
Vapor-liquid equilibria in the nitrogen + carbon dioxide + propane system from 240 to 330 K at pressures to 15 MPa
-
Yucelen, B., and A. J. Kidnay, "Vapor-Liquid Equilibria in the Nitrogen + Carbon Dioxide + Propane System from 240 to 330 K at Pressures to 15 MPa," J. Chem. Eng. Data., 44, 926 (1999).
-
(1999)
J. Chem. Eng. Data.
, vol.44
, pp. 926
-
-
Yucelen, B.1
Kidnay, A.J.2
|