-
1
-
-
25444502398
-
-
2CI), where u = 1 to 5, α = 1, and v = ω = 2 to 6. J. Chem. Thermodyn. 2005, 37, 1332-1346.
-
2CI), where u = 1 to 5, α = 1, and v = ω = 2 to 6. J. Chem. Thermodyn. 2005, 37, 1332-1346.
-
-
-
-
2
-
-
33748706144
-
-
2-Br), where u = 1 to 5, α = 1, and v = ω = 2 to 6. J. Chem. Thermodyn. 2006, 38, 585-598.
-
2-Br), where u = 1 to 5, α = 1, and v = ω = 2 to 6. J. Chem. Thermodyn. 2006, 38, 585-598.
-
-
-
-
3
-
-
33746786017
-
2Cl), where u = 1 to 5, α = 1, and v = ω = 2 to 6
-
2Cl), where u = 1 to 5, α = 1, and v = ω = 2 to 6. J. Chem. Thermodyn. 2006, 58, 1139-1149.
-
(2006)
J. Chem. Thermodyn
, vol.58
, pp. 1139-1149
-
-
Ortega, J.1
Marrero, E.2
Toledo, F.J.3
-
4
-
-
33846372250
-
-
2 Br where u = 1 to 5, α = 1, and v = ω = 2 to 6. J. Chem. Thermodyn. 2007, 39, 128-141.
-
2Br where u = 1 to 5, α = 1, and v = ω = 2 to 6. J. Chem. Thermodyn. 2007, 39, 128-141.
-
-
-
-
5
-
-
34047140551
-
2C1}, where u = 1 to 5, αααααα = 1, and v = ω = 2 to 6
-
2C1}, where u = 1 to 5, αααααα = 1, and v = ω = 2 to 6. J. Chem. Thermodyn. 2007, 39, 742-757.
-
(2007)
J. Chem. Thermodyn
, vol.39
, pp. 742-757
-
-
Ortega, J.1
Matrero, E.2
-
6
-
-
0023440004
-
Excess molar volumes of ethyl formate+1-chloroalkane at 298.15 K
-
Ortega, J.; Matos, S.; Paz-Andrade, M. I.; Fernandez, J. Excess molar volumes of ethyl formate+1-chloroalkane at 298.15 K. J. Chem. Eng. Data 1987, 32, 464-466.
-
(1987)
J. Chem. Eng. Data
, vol.32
, pp. 464-466
-
-
Ortega, J.1
Matos, S.2
Paz-Andrade, M.I.3
Fernandez, J.4
-
7
-
-
0024090071
-
Analysis of excess enthalpies of ester+1-chloroalkanes with two group contribution models: Primary parameters
-
Ortega, J.; Matos, S.; Paz-Andrade, M. I.; Fernandez, J.; Pias, L. Analysis of excess enthalpies of ester+1-chloroalkanes with two group contribution models: Primary parameters. Fluid Phase Equilib. 1988, 43, 295-316.
-
(1988)
Fluid Phase Equilib
, vol.43
, pp. 295-316
-
-
Ortega, J.1
Matos, S.2
Paz-Andrade, M.I.3
Fernandez, J.4
Pias, L.5
-
8
-
-
26644457794
-
Measurements and analysis of excess enthalpies of alkyl acetates+1-chloroalkanes using the UNIFAC model
-
Ortega, J. Measurements and analysis of excess enthalpies of alkyl acetates+1-chloroalkanes using the UNIFAC model. Ber. Bunsen-Ges. Phys. Chem. 1988, 92, 1146-1149.
-
(1988)
Ber. Bunsen-Ges. Phys. Chem
, vol.92
, pp. 1146-1149
-
-
Ortega, J.1
-
9
-
-
44649175063
-
-
Ortega, J.; Peña, J. A.; Matos, S. Int. DATA Ser., Sel. Data Mixtures., Ser. A. 1989, 85-96.
-
(1989)
Int. DATA Ser., Sel. Data Mixtures., Ser. A
, pp. 85-96
-
-
Ortega, J.1
Peña, J.A.2
Matos, S.3
-
10
-
-
0022439940
-
Prediction of enthalpies of mixing with a UNIFAC model
-
Dang, D.; Tassios, D. P. Prediction of enthalpies of mixing with a UNIFAC model. Ind. Eng. Chem. Process Des. Dev. 1986, 25, 22-31.
-
(1986)
Ind. Eng. Chem. Process Des. Dev
, vol.25
, pp. 22-31
-
-
Dang, D.1
Tassios, D.P.2
-
11
-
-
0027133251
-
A modified UNIFAC model.2. Present parameter matrix and results for different thermodynamics properties
-
Gmehling, J.; Li, M.; Schiller, M. A modified UNIFAC model.2. Present parameter matrix and results for different thermodynamics properties. Ind. Eng. Chem. Res. 1993, 32, 178-193.
-
(1993)
Ind. Eng. Chem. Res
, vol.32
, pp. 178-193
-
-
Gmehling, J.1
Li, M.2
Schiller, M.3
-
12
-
-
0029354763
-
Study on the binary mixtures of alkyl alfa, omega-dihalogenated (chlorine, bromine, iodine) with n-alkanes. An improvement by considering the variation of the interaction parameters with the chain length
-
Ortega, J.; Plácido, J. Study on the binary mixtures of alkyl alfa, omega-dihalogenated (chlorine, bromine, iodine) with n-alkanes. An improvement by considering the variation of the interaction parameters with the chain length. Fluid Phase Equilib. 1995, 109, 205-225.
-
(1995)
Fluid Phase Equilib
, vol.109
, pp. 205-225
-
-
Ortega, J.1
Plácido, J.2
-
13
-
-
85010140250
-
Vapor-liquid equilibria of methyl or ethyl acetate with 1-chloropentane or 1-chlorohexane at 101.32 kPa pressure
-
Ortega, J.; Peña, J. A. Vapor-liquid equilibria of methyl or ethyl acetate with 1-chloropentane or 1-chlorohexane at 101.32 kPa pressure. J. Chem. Eng. Jap. 1994, 27, 351-356.
-
(1994)
J. Chem. Eng. Jap
, vol.27
, pp. 351-356
-
-
Ortega, J.1
Peña, J.A.2
-
14
-
-
44649202223
-
-
Avedis, G.; Roux, A. H. M.; Grolier, J-P. E. Int. DATA Ser., Sel. Data Mixtures, Ser. A 1990, 2-5.
-
(1990)
Int. DATA Ser., Sel. Data Mixtures, Ser. A
, pp. 2-5
-
-
Avedis, G.1
Roux, A.H.M.2
Grolier, J.-P.E.3
-
15
-
-
44649202223
-
-
Avedis, G.; Roux, A. H. M.; Grolier, J-P. E. Int. DATA Ser., Sel. Data Mixtures, Ser. A 1990, 79-81.
-
(1990)
Int. DATA Ser., Sel. Data Mixtures, Ser. A
, pp. 79-81
-
-
Avedis, G.1
Roux, A.H.M.2
Grolier, J.-P.E.3
-
16
-
-
44649202223
-
-
Avedis, G.; Roux, A. H. M.; Grolier, J-P. E. Int. DATA Ser., Sel. Data Mixtures, Ser. A 1991, 175-176.
-
(1991)
Int. DATA Ser., Sel. Data Mixtures, Ser. A
, pp. 175-176
-
-
Avedis, G.1
Roux, A.H.M.2
Grolier, J.-P.E.3
-
17
-
-
84939790176
-
Measurements and analysis of excess enthalpies of ester+n-alkane using the UNIAFC model
-
Ortega, J.; Legido, J. L.; Fernandez, J.; Pías, L.; Paz Andrade, M. I. Measurements and analysis of excess enthalpies of ester+n-alkane using the UNIAFC model. Ber. Bunsen-Ges. Phys. Chem. 1991, 95 (2), 128-135.
-
(1991)
Ber. Bunsen-Ges. Phys. Chem
, vol.95
, Issue.2
, pp. 128-135
-
-
Ortega, J.1
Legido, J.L.2
Fernandez, J.3
Pías, L.4
Paz Andrade, M.I.5
-
19
-
-
0038501997
-
Prediction of halocarbon thermodynamics with COSMO-RS
-
Eckert, F.; Klamt, A. Prediction of halocarbon thermodynamics with COSMO-RS Fluid Phase Equilib. 2003, 210, 117-141.
-
(2003)
Fluid Phase Equilib
, vol.210
, pp. 117-141
-
-
Eckert, F.1
Klamt, A.2
-
20
-
-
0034725477
-
-
Klamt, A.; Eckert, F. COSMO-RS: A novel and efficient method for the a priori prediction of thermophysical data of liquids. Fluid Phase Equilib. 2000, 172, 43-72.
-
Klamt, A.; Eckert, F. COSMO-RS: A novel and efficient method for the a priori prediction of thermophysical data of liquids. Fluid Phase Equilib. 2000, 172, 43-72.
-
-
-
-
21
-
-
44649202898
-
-
Matos, J. S.; Ortega, J.; García, M. V. Int. DATA Ser., Sel. Data Mixtures, Ser. A 1991, 3; 216-223.
-
(1991)
Int. DATA Ser., Sel. Data Mixtures, Ser. A
, vol.3
, pp. 216-223
-
-
Matos, J.S.1
Ortega, J.2
García, M.V.3
-
23
-
-
0001237589
-
Isobaric Vapor-Liquid Equilibria of Methanol + Hexyl Acetate and Ethanol + Hexyl Acetate
-
Arce, A.; Soto, A.; Orge, B.; Tojo, J. Isobaric Vapor-Liquid Equilibria of Methanol + Hexyl Acetate and Ethanol + Hexyl Acetate. J. Chem. Eng. Data 1995, 40, 515-518.
-
(1995)
J. Chem. Eng. Data
, vol.40
, pp. 515-518
-
-
Arce, A.1
Soto, A.2
Orge, B.3
Tojo, J.4
-
24
-
-
44649106463
-
-
TRC Tables Non-Hydrocarbons, Thermodynamics Research Center, Texas A&M University: College Station, TX, 1991.
-
TRC Tables Non-Hydrocarbons, Thermodynamics Research Center, Texas A&M University: College Station, TX, 1991.
-
-
-
-
25
-
-
0003473659
-
-
4th ed, Wiley: New York
-
Riddick, J. A.; Bunger, W. B.; Sakano, T. K. Organic Solvents. Techniques of Chemistry, 4th ed.; Wiley: New York, 1986; Vol. 2.
-
(1986)
Organic Solvents. Techniques of Chemistry
, vol.2
-
-
Riddick, J.A.1
Bunger, W.B.2
Sakano, T.K.3
-
26
-
-
0038403636
-
Excess molar volumes of (octane + 1-chlorobutane) at temperatures between 298.15 and 328.15 K and at pressures up to 40 MPa
-
Moravkova, L.; Linek, J. Excess molar volumes of (octane + 1-chlorobutane) at temperatures between 298.15 and 328.15 K and at pressures up to 40 MPa. J. Chem. Thermodyn. 2003, 35, 113-121.
-
(2003)
J. Chem. Thermodyn
, vol.35
, pp. 113-121
-
-
Moravkova, L.1
Linek, J.2
-
27
-
-
0002670840
-
-
Vidal, M, Ortega, J, Plácido, J. Thermodynamic properties of (an ethyl ester, and n-alkane) IX. HmE and V mE for {xCH3(CH2) uCOOCH2CH3, 1-x)CH3(CH 2)2v+ 1CH3) with u, 0 to 5, and v, 1 to 7. J. Chem. Thermodyn. 1997, 29, 47-74
-
3) with u = 0 to 5, and v = 1 to 7. J. Chem. Thermodyn. 1997, 29, 47-74.
-
-
-
-
30
-
-
0036473751
-
Fast solvent screening via quantum chemistry: COSMO-RS approach
-
Klamt, A.; Eckert, F. Fast solvent screening via quantum chemistry: COSMO-RS approach. AIChE J. 2002, 48, 369-385.
-
(2002)
AIChE J
, vol.48
, pp. 369-385
-
-
Klamt, A.1
Eckert, F.2
-
31
-
-
44649154535
-
-
Frisch, M. J, Trucks, G. W, Schlegel, H. B, Scuseria, G. E, Robb, M. A, Cheeseman, J. R, Montgomery, J. A, Jr, Vreven, T, Kudin, K. N, Burant, J. C, Millam, J. M, Iyengar, S. S, Tomasi, J, Barone, V, Mennucci, B, Cossi, M, Scalmani, G, Rega, N, Petersson, G. A, Nakatsuji, H, Hada, M, Ehara, M, Toyota, K, Fukuda, R, Hasegawa, J, Ishida, M, Nakajima, T, Honda, Y, Kitao, O, Nakai, H, Klene, M, Li, X, Knox, J. E, Hratchian, H. P, Cross, J. B, Bakken, V, Adamo, C, Jaramillo, J, Gomperts, R, Stratmann, R. E, Yazyev, O, Austin, A. J, Cammi, R, Pomelli, C, Ochterski, J. W, Ayala, P. Y, Morokuma, K, Voth, G. A, Salvador, P, Dannenberg, J. J, Zakrzewski, V. G, Dapprich, S, Daniels, A. D, Strain, M. C, Farkas, O, Malick, D. K, Rabuck, A. D, Raghavachari, K, Foresman, J. B, Ortiz, J. V, Cui, Q, Baboul, A. G, Clifford, S, Cioslowski, J, Stefanov, B. B, Liu, G, Liashenko, A, Piskorz, P, Komaromi, I, Martin, R. L, Fox, D. J, Keit
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Montgomery, J. A., Jr.; Vreven, T.; Kudin, K. N.; Burant, J. C.; Millam, J. M.; Iyengar, S. S.; Tomasi, J.; Barone, V.; Mennucci, B.; Cossi, M.; Scalmani, G.; Rega, N.; Petersson, G. A.; Nakatsuji, H.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Klene, M.; Li, X.; Knox, J. E.; Hratchian, H. P.; Cross, J. B.; Bakken, V.; Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J. W.; Ayala, P. Y.; Morokuma, K.; Voth, G. A.; Salvador, P.; Dannenberg, J. J.; Zakrzewski, V. G.; Dapprich, S.; Daniels, A. D.; Strain, M. C.; Farkas, O.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Ortiz, J. V.; Cui, Q.; Baboul, A. G.; Clifford, S.; Cioslowski, J.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Challacombe, M.; Gill, P. M. W.; Johnson, B.; Chen, W.; Wong, M. W.; Gonzalez, C.; Pople, J. A. Gaussian 03, revision 6.0; Gaussian, Inc.: Wallingford, CT, 2004.
-
-
-
-
32
-
-
44649145338
-
-
Eckert, F, Klamt, A. COSMOtherm, version C2.1, release 01.06, COSMOlogicGmbH & CO. KG: Leverkusen, Germany, 2006
-
Eckert, F.; Klamt, A. COSMOtherm, version C2.1, release 01.06, COSMOlogicGmbH & CO. KG: Leverkusen, Germany, 2006.
-
-
-
-
33
-
-
0001104791
-
-
Allinger, L, Eds, Wiley: New York
-
Klamt, A. Encyclopedia of Computational Chemistry, Schleyer, P. v. R., Allinger, L., Eds.; Wiley: New York, 1998; pp 604-615.
-
(1998)
Encyclopedia of Computational Chemistry, Schleyer, P
, vol.R
, pp. 604-615
-
-
Klamt, A.1
-
34
-
-
35148837210
-
Prediction, fine tuning, and temperature extrapolation of a vapor liquid equilibrium using COSMOtherm
-
Klamt, A.; Eckert, F. Prediction, fine tuning, and temperature extrapolation of a vapor liquid equilibrium using COSMOtherm. Fluid Phase Equilib. 2007, 260, 183-189.
-
(2007)
Fluid Phase Equilib
, vol.260
, pp. 183-189
-
-
Klamt, A.1
Eckert, F.2
|