-
3
-
-
64749095083
-
2 Separations in Imidazolium-Based Room-Temperature Ionic Liquids
-
2 Separations in Imidazolium-Based Room-Temperature Ionic Liquids Ind. Eng. Chem. Res. 2009, 48, 2739-2751
-
(2009)
Ind. Eng. Chem. Res.
, vol.48
, pp. 2739-2751
-
-
Bara, J.E.1
Carlisle, T.K.2
Gabriel, C.J.3
Camper, D.4
Finotello, A.5
Gin, D.L.6
Noble, R.D.7
-
4
-
-
78149232538
-
2 Capture Technologies
-
2 Capture Technologies Energy. Environ. Sci. 2010, 3, 1645-1669
-
(2010)
Energy. Environ. Sci.
, vol.3
, pp. 1645-1669
-
-
Macdowell, N.1
Florin, N.2
Buchard, A.3
Hallett, J.4
Galindo, A.5
Jackson, G.6
Adjiman, C.S.7
Williams, C.K.8
Shah, N.9
Fennell, P.10
-
5
-
-
1942424942
-
2 so Soluble in Imidazolium-Based Ionic Liquids?
-
2 So Soluble in Imidazolium-Based Ionic Liquids? J. Am. Chem. Soc. 2004, 126, 5300-5308
-
(2004)
J. Am. Chem. Soc.
, vol.126
, pp. 5300-5308
-
-
Cadena, C.1
Anthony, J.L.2
Shah, J.K.3
Morrow, T.I.4
Brennecke, J.F.5
Maginn, E.J.6
-
6
-
-
0037173845
-
Solubilities and Thermodynamic Properties of Gases in the Ionic Liquid 1-n-Butyl-3-methylimidazolium Hexafluorophosphate
-
Anthony, J. L.; Maginn, E. J.; Brennecke, J. F. Solubilities and Thermodynamic Properties of Gases in the Ionic Liquid 1-n-Butyl-3-methylimidazolium Hexafluorophosphate J. Phys. Chem. B 2002, 106, 7315-7320
-
(2002)
J. Phys. Chem. B
, vol.106
, pp. 7315-7320
-
-
Anthony, J.L.1
Maginn, E.J.2
Brennecke, J.F.3
-
9
-
-
33646790171
-
2 by Tetrabutylphosphonium Amino Acid Ionic Liquids
-
2 by Tetrabutylphosphonium Amino Acid Ionic Liquids Chem.-Eur. J. 2006, 12, 4021-4026
-
(2006)
Chem.-Eur. J.
, vol.12
, pp. 4021-4026
-
-
Zhang, J.1
Zhang, S.2
Dong, K.3
Zhang, Y.4
Shen, Y.5
Lv, X.6
-
10
-
-
62349121023
-
2 Capture
-
2 Capture Chem.-Eur. J. 2009, 15, 3003-3011
-
(2009)
Chem.-Eur. J.
, vol.15
, pp. 3003-3011
-
-
Zhang, Y.1
Zhang, S.2
Lu, X.3
Zhou, Q.4
Fan, W.5
Zhang, X.6
-
11
-
-
78650413073
-
Experimental Measurements of Amine-Functionalized Anion-Tethered Ionic Liquids with Carbon Dioxide
-
Goodrich, B. F.; de la Fuente, J. C.; Gurkan, B. E.; Zadigian, D. J.; Price, E. A.; Huang, Y.; Brennecke, J. F. Experimental Measurements of Amine-Functionalized Anion-Tethered Ionic Liquids with Carbon Dioxide Ind. Eng. Chem. Res. 2011, 50, 111-118
-
(2011)
Ind. Eng. Chem. Res.
, vol.50
, pp. 111-118
-
-
Goodrich, B.F.1
De La Fuente, J.C.2
Gurkan, B.E.3
Zadigian, D.J.4
Price, E.A.5
Huang, Y.6
Brennecke, J.F.7
-
12
-
-
79960633985
-
2 by Amine-Functionalized Anion-Tethered Ionic Liquids
-
2 by Amine-Functionalized Anion-Tethered Ionic Liquids J. Phys. Chem. B 2011, 115, 9140-9150
-
(2011)
J. Phys. Chem. B
, vol.115
, pp. 9140-9150
-
-
Goodrich, B.F.1
De La Fuente, J.C.2
Gurkan, B.E.3
Lopez, Z.K.4
Price, E.A.5
Huang, Y.6
Brennecke, J.F.7
-
13
-
-
77950792018
-
2 Absorption by Anion-Functionalized Ionic Liquids
-
2 Absorption by Anion-Functionalized Ionic Liquids J. Am. Chem. Soc. 2010, 132, 2116-2117
-
(2010)
J. Am. Chem. Soc.
, vol.132
, pp. 2116-2117
-
-
Gurkan, B.E.1
De La Fuente, J.C.2
Mindrup, E.M.3
Ficke, L.E.4
Goodrich, B.F.5
Price, E.A.6
Schneider, W.F.7
Brennecke, J.F.8
-
14
-
-
78650360156
-
2 Capture
-
2 Capture J. Phys. Chem. Lett. 2010, 1, 3494-3499
-
(2010)
J. Phys. Chem. Lett.
, vol.1
, pp. 3494-3499
-
-
Gurkan, B.1
Goodrich, B.F.2
Mindrup, E.M.3
Ficke, L.E.4
Massel, M.5
Seo, S.6
Senftle, T.P.7
Wu, H.8
Glaser, M.F.9
Shah, J.K.10
-
15
-
-
78049366793
-
2 Capture by Imidazolium-Based Ionic Liquids and Superbase Systems
-
2 Capture by Imidazolium-Based Ionic Liquids and Superbase Systems Green Chem. 2010, 12, 2019-2023
-
(2010)
Green Chem.
, vol.12
, pp. 2019-2023
-
-
Wang, C.1
Luo, H.2
Luo, X.3
Li, H.4
Dai, S.5
-
16
-
-
77955589306
-
Carbon Dioxide Capture by Superbase-Derived Protic Ionic Liquids
-
Wang, C.; Luo, H.; Jiang, D.; Li, H.; Dai, S. Carbon Dioxide Capture by Superbase-Derived Protic Ionic Liquids Angew. Chem., Int. Ed. 2010, 49, 5978-5981
-
(2010)
Angew. Chem., Int. Ed.
, vol.49
, pp. 5978-5981
-
-
Wang, C.1
Luo, H.2
Jiang, D.3
Li, H.4
Dai, S.5
-
17
-
-
77952365804
-
2 Capture by Equimolar Task-Specific Ionic Liquid-Superbase Mixtures
-
2 Capture by Equimolar Task-Specific Ionic Liquid-Superbase Mixtures Green Chem. 2010, 12, 870-874
-
(2010)
Green Chem.
, vol.12
, pp. 870-874
-
-
Wang, C.1
Mahurin, S.M.2
Luo, H.3
Baker, G.A.4
Li, H.5
Dai, S.6
-
18
-
-
84863011223
-
2 Capture by the Substituent on the Anion
-
2 Capture by the Substituent on the Anion Chem.-Eur. J. 2012, 18, 2153-2160
-
(2012)
Chem.-Eur. J.
, vol.18
, pp. 2153-2160
-
-
Wang, C.1
Luo, H.2
Li, H.3
Zhu, X.4
Yu, B.5
Dai, S.6
-
19
-
-
79955771763
-
2 Capture
-
2 Capture Angew. Chem., Int. Ed. 2011, 50, 4918-4922
-
(2011)
Angew. Chem., Int. Ed.
, vol.50
, pp. 4918-4922
-
-
Wang, C.1
Luo, X.2
Luo, H.3
Jiang, D.4
Li, H.5
Dai, S.6
-
20
-
-
79961148478
-
2 Capture by Tunable Azole-Based Ionic Liquids through Multiple-Site Chemical Absorption
-
2 Capture by Tunable Azole-Based Ionic Liquids through Multiple-Site Chemical Absorption J. Am. Chem. Soc. 2011, 133, 11916-11919
-
(2011)
J. Am. Chem. Soc.
, vol.133
, pp. 11916-11919
-
-
Wang, C.1
Cui, G.2
Luo, X.3
Xu, Y.J.4
Li, H.5
Dai, S.6
-
21
-
-
84872352291
-
2
-
2 Chem. Commun. 2013, 49, 1166-1168
-
(2013)
Chem. Commun.
, vol.49
, pp. 1166-1168
-
-
Wang, C.1
Zheng, J.2
Cui, G.3
Luo, X.4
Guo, Y.5
Li, H.6
-
22
-
-
84884897886
-
2 Capture
-
2 Capture Angew. Chem., Int. Ed. 2013, 52, 10620-10624
-
(2013)
Angew. Chem., Int. Ed.
, vol.52
, pp. 10620-10624
-
-
Cui, G.1
Zheng, J.2
Luo, X.3
Lin, W.4
Ding, F.5
Li, H.6
Wang, C.7
-
23
-
-
84863297420
-
Hydrogen Bonds: A Structural Insight into Ionic Liquids
-
Dong, K.; Zhang, S. Hydrogen Bonds: A Structural Insight into Ionic Liquids Chem.-Eur. J. 2012, 18, 2748-2761
-
(2012)
Chem.-Eur. J.
, vol.18
, pp. 2748-2761
-
-
Dong, K.1
Zhang, S.2
-
26
-
-
46249092554
-
GROMACS 4: Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation
-
Hess, B.; Kutzner, C.; van der Spoel, D.; Lindahl, E. GROMACS 4: Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation J. Chem. Theory Comput. 2008, 4, 435-447
-
(2008)
J. Chem. Theory Comput.
, vol.4
, pp. 435-447
-
-
Hess, B.1
Kutzner, C.2
Van Der Spoel, D.3
Lindahl, E.4
-
27
-
-
27344454932
-
GROMACS: Fast, Flexible, and Free
-
Van der Spoel, D.; Lindahl, E.; Hess, B.; Groenhof, G.; Mark, A. E.; Berendsen, H. J. C. GROMACS: Fast, Flexible, and Free J. Comput. Chem. 2005, 26, 1701-1718
-
(2005)
J. Comput. Chem.
, vol.26
, pp. 1701-1718
-
-
Van Der Spoel, D.1
Lindahl, E.2
Hess, B.3
Groenhof, G.4
Mark, A.E.5
Berendsen, H.J.C.6
-
28
-
-
0029633168
-
GROMACS: A Message-Passing Parallel Molecular Dynamics Implementation
-
Berendsen, H. J. C.; van der Spoel, D.; van Drunen, R. GROMACS: A Message-Passing Parallel Molecular Dynamics Implementation Comput. Phys. Commun. 1995, 91, 43-56
-
(1995)
Comput. Phys. Commun.
, vol.91
, pp. 43-56
-
-
Berendsen, H.J.C.1
Van Der Spoel, D.2
Van Drunen, R.3
-
29
-
-
0029912748
-
Development and Testing of the OPLS All-Atom Force Field on Conformational Energetics and Properties of Organic Liquids
-
Jorgensen, W. L.; Maxwell, D. S.; Tirado-Rives, J. Development and Testing of the OPLS All-Atom Force Field on Conformational Energetics and Properties of Organic Liquids J. Am. Chem. Soc. 1996, 118, 11225-11236
-
(1996)
J. Am. Chem. Soc.
, vol.118
, pp. 11225-11236
-
-
Jorgensen, W.L.1
Maxwell, D.S.2
Tirado-Rives, J.3
-
30
-
-
33750349101
-
Molecular Force Field for Ionic Liquids III: Imidazolium, Pyridinium, and Phosphonium Cations; Chloride, Bromide, and Dicyanamide Anions
-
Lopes, J. N. C.; Pádua, A. A. H. Molecular Force Field for Ionic Liquids III: Imidazolium, Pyridinium, and Phosphonium Cations; Chloride, Bromide, and Dicyanamide Anions J. Phys. Chem. B 2006, 110, 19586-19592
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 19586-19592
-
-
Lopes, J.N.C.1
Pádua, A.A.H.2
-
31
-
-
0000726604
-
Development of an All-Atom Force Field for Heterocycles. Properties of Liquid Pyrrole, Furan, Diazoles, and Oxazoles
-
McDonald, N. A.; Jorgensen, W. L. Development of an All-Atom Force Field for Heterocycles. Properties of Liquid Pyrrole, Furan, Diazoles, and Oxazoles J. Phys. Chem. B 1998, 102, 8049-8059
-
(1998)
J. Phys. Chem. B
, vol.102
, pp. 8049-8059
-
-
McDonald, N.A.1
Jorgensen, W.L.2
-
32
-
-
0029011701
-
A Second Generation Force Field for the Simulation of Proteins, Nucleic Acids, and Organic Molecules
-
Cornell, W. D.; Cieplak, P.; Bayly, C. I.; Gould, I. R.; Merz, K. M.; Ferguson, D. M.; Spellmeyer, D. C.; Fox, T.; Caldwell, J. W.; Kollman, P. A. A Second Generation Force Field for the Simulation of Proteins, Nucleic Acids, and Organic Molecules J. Am. Chem. Soc. 1995, 117, 5179-5197
-
(1995)
J. Am. Chem. Soc.
, vol.117
, pp. 5179-5197
-
-
Cornell, W.D.1
Cieplak, P.2
Bayly, C.I.3
Gould, I.R.4
Merz, K.M.5
Ferguson, D.M.6
Spellmeyer, D.C.7
Fox, T.8
Caldwell, J.W.9
Kollman, P.A.10
-
33
-
-
0000730887
-
Application of the RESP Methodology in the Parameterization of Organic Solvents
-
Fox, T.; Kollman, P. A. Application of the RESP Methodology in the Parameterization of Organic Solvents J. Phys. Chem. B 1998, 102, 8070-8079
-
(1998)
J. Phys. Chem. B
, vol.102
, pp. 8070-8079
-
-
Fox, T.1
Kollman, P.A.2
-
34
-
-
0038626673
-
-
revision C.02; Gaussian, Inc. Wallingford, CT
-
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.;; Gaussian 03, revision C.02; Gaussian, Inc.: Wallingford, CT, 2004.
-
(2004)
Gaussian 03
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Montgomery, J.A.7
Vreven, T.8
Kudin, K.N.9
Burant, J.C.10
-
35
-
-
33645961739
-
A Smooth Particle Mesh Ewald Method
-
Essmann, U.; Perera, L.; Berkowitz, M. L.; Darden, T.; Lee, H.; Pedersen, L. G. A Smooth Particle Mesh Ewald Method J. Chem. Phys. 1995, 103, 8577-8593
-
(1995)
J. Chem. Phys.
, vol.103
, pp. 8577-8593
-
-
Essmann, U.1
Perera, L.2
Berkowitz, M.L.3
Darden, T.4
Lee, H.5
Pedersen, L.G.6
-
36
-
-
0036140611
-
Determining the Shear Viscosity of Model Liquids from Molecular Dynamics Simulations
-
Hess, B. Determining the Shear Viscosity of Model Liquids from Molecular Dynamics Simulations J. Chem. Phys. 2002, 116, 209-217
-
(2002)
J. Chem. Phys.
, vol.116
, pp. 209-217
-
-
Hess, B.1
-
38
-
-
22944489606
-
Single Particle Dynamics in Ionic Liquids of 1-Alkyl-3-methylimidazolium Cations
-
Urahata, S. M.; Ribeiro, M. C. C. Single Particle Dynamics in Ionic Liquids of 1-Alkyl-3-methylimidazolium Cations J. Chem. Phys. 2005, 122, 024511
-
(2005)
J. Chem. Phys.
, vol.122
, pp. 024511
-
-
Urahata, S.M.1
Ribeiro, M.C.C.2
-
39
-
-
67650072736
-
Liquid Structure of Trihexyltetradecylphosphonium Chloride at Ambient Temperature: An X-ray Scattering and Simulation Study
-
Gontrani, L.; Russina, O.; Lo Celso, F.; Caminiti, R.; Annat, G.; Triolo, A. Liquid Structure of Trihexyltetradecylphosphonium Chloride at Ambient Temperature: An X-ray Scattering and Simulation Study J. Phys. Chem. B 2009, 113, 9235-9240
-
(2009)
J. Phys. Chem. B
, vol.113
, pp. 9235-9240
-
-
Gontrani, L.1
Russina, O.2
Lo Celso, F.3
Caminiti, R.4
Annat, G.5
Triolo, A.6
-
40
-
-
70449891416
-
Are There Stable Ion-Pairs in Room-Temperature Ionic Liquids? Molecular Dynamics Simulations of 1-n-Butyl-3-methylimidazolium Hexafluorophosphate
-
Zhao, W.; Leroy, F.; Heggen, B.; Zahn, S.; Kirchner, B.; Balasubramanian, S.; Müller-Plathe, F. Are There Stable Ion-Pairs in Room-Temperature Ionic Liquids? Molecular Dynamics Simulations of 1-n-Butyl-3-methylimidazolium Hexafluorophosphate J. Am. Chem. Soc. 2009, 131, 15825-15833
-
(2009)
J. Am. Chem. Soc.
, vol.131
, pp. 15825-15833
-
-
Zhao, W.1
Leroy, F.2
Heggen, B.3
Zahn, S.4
Kirchner, B.5
Balasubramanian, S.6
Müller-Plathe, F.7
-
41
-
-
49749135179
-
Structural and Dynamical Properties of Ionic Liquids: The Influence of Ion Size Disparity
-
Spohr, H. V.; Patey, G. N. Structural and Dynamical Properties of Ionic Liquids: The Influence of Ion Size Disparity J. Chem. Phys. 2008, 129, 064517
-
(2008)
J. Chem. Phys.
, vol.129
, pp. 064517
-
-
Spohr, H.V.1
Patey, G.N.2
-
42
-
-
84860296166
-
Microstructures and Interaction Analyses of Phosphonium-Based Ionic Liquids: A Simulation Study
-
Liu, X.; Zhao, Y.; Zhang, X.; Zhou, G.; Zhang, S. Microstructures and Interaction Analyses of Phosphonium-Based Ionic Liquids: A Simulation Study J. Phys. Chem. B 2012, 116, 4934-4942
-
(2012)
J. Phys. Chem. B
, vol.116
, pp. 4934-4942
-
-
Liu, X.1
Zhao, Y.2
Zhang, X.3
Zhou, G.4
Zhang, S.5
-
43
-
-
84897106361
-
Importance of Dispersion Forces for Prediction of Thermodynamic and Transport Properties of Some Common Ionic Liquids
-
Izgorodina, E. I.; Golze, D.; Maganti, R.; Armel, V.; Taige, M.; Schubert, T. J. S.; MacFarlane, D. R. Importance of Dispersion Forces for Prediction of Thermodynamic and Transport Properties of Some Common Ionic Liquids Phys. Chem. Chem. Phys. 2014, 16, 7209-7221
-
(2014)
Phys. Chem. Chem. Phys.
, vol.16
, pp. 7209-7221
-
-
Izgorodina, E.I.1
Golze, D.2
Maganti, R.3
Armel, V.4
Taige, M.5
Schubert, T.J.S.6
Macfarlane, D.R.7
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