-
1
-
-
33751304498
-
6])
-
6]) J. Phys. Chem. B 2006, 110, 21357
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 21357
-
-
Triolo, A.1
Mandanici, A.2
Russina, O.3
Rodriguez-Mora, V.4
Cutroni, M.5
Hardacre, C.6
Nieuwenhuyzen, M.7
Bleif, H.-J.8
Keller, L.9
Ramos, M.A.10
-
2
-
-
78649495652
-
Nanostructure of Trialkylmethylammonium Bistriflamide Ionic Liquids Studied by Molecular Dynamics
-
Shimizu, K.; Padua, A. A. H.; Canongia Lopes, J. N. A. Nanostructure of Trialkylmethylammonium Bistriflamide Ionic Liquids Studied by Molecular Dynamics J. Phys. Chem. B 2010, 114, 15635
-
(2010)
J. Phys. Chem. B
, vol.114
, pp. 15635
-
-
Shimizu, K.1
Padua, A.A.H.2
Canongia Lopes, J.N.A.3
-
3
-
-
29344470489
-
Intermolecular Structure and Dynamics in an Ionic Liquid: A Car-Parrinello Molecular Dynamics Simulation Study of 1,3-Dimethylimidazolium Chloride
-
Bhargava, B. L.; Balasubramanian, S. Intermolecular Structure and Dynamics in an Ionic Liquid: A Car-Parrinello Molecular Dynamics Simulation Study of 1,3-Dimethylimidazolium Chloride Chem. Phys. Lett. 2006, 417, 486
-
(2006)
Chem. Phys. Lett.
, vol.417
, pp. 486
-
-
Bhargava, B.L.1
Balasubramanian, S.2
-
4
-
-
35348871846
-
Nanoscale Organization in Room Temperature Ionic Liquids: A Coarse Grained Molecular Dynamics Simulation Study
-
Bhargava, B. L.; Devane, R.; Klein, M. L.; Balasubramanian, S. Nanoscale Organization in Room Temperature Ionic Liquids: A Coarse Grained Molecular Dynamics Simulation Study Soft Matter 2007, 3, 1395
-
(2007)
Soft Matter
, vol.3
, pp. 1395
-
-
Bhargava, B.L.1
Devane, R.2
Klein, M.L.3
Balasubramanian, S.4
-
5
-
-
49149090699
-
Liquid Structure of the Ionic Liquid, 1-Methyl-4-cyanopyridinium Bis{(trifluoromethyl)sulfonyl}imide Determined from Neutron Scattering and Molecular Dynamics Simulations
-
Hardacre, C.; Holbrey, J. D.; Mullan, C. L.; Nieuwenhuyzen, M.; Youngs, T. G. A.; Bowron, D. T. Liquid Structure of the Ionic Liquid, 1-Methyl-4-cyanopyridinium Bis{(trifluoromethyl)sulfonyl}imide Determined from Neutron Scattering and Molecular Dynamics Simulations J. Phys. Chem. B 2008, 112, 8049
-
(2008)
J. Phys. Chem. B
, vol.112
, pp. 8049
-
-
Hardacre, C.1
Holbrey, J.D.2
Mullan, C.L.3
Nieuwenhuyzen, M.4
Youngs, T.G.A.5
Bowron, D.T.6
-
6
-
-
77956078380
-
6], n = 4, 6, and 8)
-
6], n = 4, 6, and 8) J. Chem. Phys. 2010, 133, 74510
-
(2010)
J. Chem. Phys.
, vol.133
, pp. 74510
-
-
Hardacre, C.1
Holbrey, J.D.2
Mullan, C.L.3
Youngs, T.G.A.4
Bowron, D.T.5
-
7
-
-
84857530257
-
The Structure of Liquid N -Methyl Pyrrolidone Probed by X-ray Scattering and Molecular Simulations
-
Gontrani, L.; Caminiti, R. The Structure of Liquid N -Methyl Pyrrolidone Probed by X-ray Scattering and Molecular Simulations J. Chem. Phys. 2012, 136, 74505
-
(2012)
J. Chem. Phys.
, vol.136
, pp. 74505
-
-
Gontrani, L.1
Caminiti, R.2
-
8
-
-
84860335005
-
Comparing Intermediate Range Order for Alkyl-vs. Ether-Substituted Cations in Ionic Liquids
-
Triolo, A.; Russina, O.; Caminiti, R.; Shirota, H.; Lee, H. Y.; Santos, C. S.; Murthy, N. S.; Castner, E. W., Jr. Comparing Intermediate Range Order for Alkyl-vs. Ether-Substituted Cations in Ionic Liquids Chem. Commun. 2012, 48, 4959
-
(2012)
Chem. Commun.
, vol.48
, pp. 4959
-
-
Triolo, A.1
Russina, O.2
Caminiti, R.3
Shirota, H.4
Lee, H.Y.5
Santos, C.S.6
Murthy, N.S.7
Castner Jr., E.W.8
-
9
-
-
79951789754
-
Temperature-Dependent Structure of Methyltributylammonium Bis(trifluoromethylsulfonyl)amide: X-ray Scattering and Simulations
-
Santos, C. S.; Annapureddy, H. V. R.; Murthy, N. S.; Kashyap, H. K.; Castner, E. W., Jr.; Margulis, C. J. Temperature-Dependent Structure of Methyltributylammonium Bis(trifluoromethylsulfonyl)amide: X-ray Scattering and Simulations J. Chem. Phys. 2011, 134, 064501
-
(2011)
J. Chem. Phys.
, vol.134
, pp. 064501
-
-
Santos, C.S.1
Annapureddy, H.V.R.2
Murthy, N.S.3
Kashyap, H.K.4
Castner Jr., E.W.5
Margulis, C.J.6
-
10
-
-
34547139800
-
Molecular Dynamics Simulation of Polymer Electrolytes Based on Poly(ethylene oxide) and Ionic Liquids. I. Structural Properties
-
Costa, L. T.; Ribeiro, M. C. C. Molecular Dynamics Simulation of Polymer Electrolytes Based on Poly(ethylene oxide) and Ionic Liquids. I. Structural Properties J. Chem. Phys. 2006, 124, 184902
-
(2006)
J. Chem. Phys.
, vol.124
, pp. 184902
-
-
Costa, L.T.1
Ribeiro, M.C.C.2
-
11
-
-
33745713390
-
Structure and Dynamics of N -Methyl-N -propylpyrrolidinium Bis(trifluoromethanesulfonyl)imide Ionic Liquid from Molecular Dynamics Simulations
-
Borodin, O.; Smith, G. D. Structure and Dynamics of N -Methyl-N -propylpyrrolidinium Bis(trifluoromethanesulfonyl)imide Ionic Liquid from Molecular Dynamics Simulations J. Phys. Chem. B 2006, 110, 11481
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 11481
-
-
Borodin, O.1
Smith, G.D.2
-
12
-
-
37449000115
-
Structure and Solvation in Ionic Liquids
-
Hardacre, C.; Holbrey, J. D.; Nieuwenhuyzen, M.; Youngs, T. G. A. Structure and Solvation in Ionic Liquids Acc. Chem. Res. 2007, 40, 1146
-
(2007)
Acc. Chem. Res.
, vol.40
, pp. 1146
-
-
Hardacre, C.1
Holbrey, J.D.2
Nieuwenhuyzen, M.3
Youngs, T.G.A.4
-
13
-
-
79953179356
-
Liquid Structure of 1-Alkyl-3-methylimidazolium-hexafluorophosphates by Wide Angle X-ray and Neutron Scattering and Molecular Dynamics
-
Macchiagodena, M.; Gontrani, L.; Ramondo, F.; Triolo, A.; Caminiti, R. Liquid Structure of 1-Alkyl-3-methylimidazolium-hexafluorophosphates by Wide Angle X-ray and Neutron Scattering and Molecular Dynamics J. Chem. Phys. 2011, 134, 114521
-
(2011)
J. Chem. Phys.
, vol.134
, pp. 114521
-
-
MacChiagodena, M.1
Gontrani, L.2
Ramondo, F.3
Triolo, A.4
Caminiti, R.5
-
15
-
-
79951790817
-
Ionic Liquids: Structure and Photochemical Reactions
-
Castner, E. W., Jr.; Margulis, C. J.; Maroncelli, M.; Wishart, J. F. Ionic Liquids: Structure and Photochemical Reactions Annu. Rev. Phys. Chem. 2011, 62, 85
-
(2011)
Annu. Rev. Phys. Chem.
, vol.62
, pp. 85
-
-
Castner Jr., E.W.1
Margulis, C.J.2
Maroncelli, M.3
Wishart, J.F.4
-
16
-
-
0037085198
-
Influence of Structural Variations in 1-Alkyl(aralkyl)-3- methylimidazolium Hexafluorophosphates and Bis(trifluoromethylsulfonyl)imides on Physical Properties of the Ionic Liquids
-
Dzyuba, S. V.; Bartsch, R. A. Influence of Structural Variations in 1-Alkyl(aralkyl)-3-methylimidazolium Hexafluorophosphates and Bis(trifluoromethylsulfonyl)imides on Physical Properties of the Ionic Liquids ChemPhysChem 2002, 3, 161
-
(2002)
ChemPhysChem
, vol.3
, pp. 161
-
-
Dzyuba, S.V.1
Bartsch, R.A.2
-
17
-
-
57249104607
-
1-n -Butyl-3-methylimidazolium ([bmim]) Octylsulfate -An even "greener" Ionic Liquid
-
Wasserscheid, P.; Hal, R. v.; Bosmann, A. 1-n -Butyl-3-methylimidazolium ([bmim]) Octylsulfate-An Even "Greener" Ionic Liquid Green Chem. 2002, 4, 400
-
(2002)
Green Chem.
, vol.4
, pp. 400
-
-
Wasserscheid, P.1
Hal, R.V.2
Bosmann, A.3
-
18
-
-
39749199732
-
Ionic Liquids in Separation Techniques
-
Berthod, A.; Ruiz-Angel, M. J.; Carda-Broch, S. Ionic Liquids in Separation Techniques J. Chromatogr. A 2008, 1184, 6
-
(2008)
J. Chromatogr. A
, vol.1184
, pp. 6
-
-
Berthod, A.1
Ruiz-Angel, M.J.2
Carda-Broch, S.3
-
19
-
-
77951896609
-
Physico-Chemical Properties and Phase Behaviour of Pyrrolidinium-Based Ionic Liquids
-
Domanska, U. Physico-Chemical Properties and Phase Behaviour of Pyrrolidinium-Based Ionic Liquids Int. J. Mol. Sci. 2010, 11, 1825
-
(2010)
Int. J. Mol. Sci.
, vol.11
, pp. 1825
-
-
Domanska, U.1
-
20
-
-
0032465986
-
Synthesis and Physical-Chemical Properties of Ionic Liquids Based on 1-n -Butyl-3-methylimidazolium cation
-
Suarez, P. A. Z.; Einloft, S.; Dullius, J. E. L.; de Souza, R. F.; Dupont, J. Synthesis and Physical-Chemical Properties of Ionic Liquids Based on 1-n -Butyl-3-methylimidazolium cation J. Chim. Phys. 1998, 95, 1626
-
(1998)
J. Chim. Phys.
, vol.95
, pp. 1626
-
-
Suarez, P.A.Z.1
Einloft, S.2
Dullius, J.E.L.3
De Souza, R.F.4
Dupont, J.5
-
21
-
-
0000034575
-
Ionic Liquids -New "solutions" for Transition Metal Catalysis
-
Wasserscheid, P.; Keim, W. Ionic Liquids-New "Solutions" for Transition Metal Catalysis Angew. Chem., Int. Ed. 2000, 39, 3772
-
(2000)
Angew. Chem., Int. Ed.
, vol.39
, pp. 3772
-
-
Wasserscheid, P.1
Keim, W.2
-
22
-
-
1942476083
-
Room Temperature Ionic Liquids and Their Mixtures: A Review
-
Marsh, K. N.; Boxall, J. A.; Lichtenthaler, R. Room Temperature Ionic Liquids and Their Mixtures: A Review Fluid Phase Equilib. 2004, 219, 93
-
(2004)
Fluid Phase Equilib.
, vol.219
, pp. 93
-
-
Marsh, K.N.1
Boxall, J.A.2
Lichtenthaler, R.3
-
23
-
-
33744484005
-
Effect of Tetrabutylphosphonium Cation on the Physico-Chemical Properties of Amino-Acid Ionic Liquids
-
Kagimoto, J.; Fukumoto, K.; Ohno, H. Effect of Tetrabutylphosphonium Cation on the Physico-Chemical Properties of Amino-Acid Ionic Liquids Chem. Commun. 2006, 21, 2254
-
(2006)
Chem. Commun.
, vol.21
, pp. 2254
-
-
Kagimoto, J.1
Fukumoto, K.2
Ohno, H.3
-
24
-
-
33645458303
-
Density and Viscosity of Several Pure and Water-Saturated Ionic Liquids
-
Jacquemin, J.; Husson, P.; Padua, A. A. H.; Majer, V. Density and Viscosity of Several Pure and Water-Saturated Ionic Liquids Green Chem. 2006, 8, 172
-
(2006)
Green Chem.
, vol.8
, pp. 172
-
-
Jacquemin, J.1
Husson, P.2
Padua, A.A.H.3
Majer, V.4
-
25
-
-
35348825453
-
Physicochemical Properties and Toxicities of Hydrophobic Piperidinium and Pyrrolidinium Ionic Liquids
-
Salminen, J.; Papaiconomou, N.; Kumar, R. A.; Lee, J.-M.; Kerr, J.; Newman, J.; Prausnitz, J. M. Physicochemical Properties and Toxicities of Hydrophobic Piperidinium and Pyrrolidinium Ionic Liquids Fluid Phase Equilib. 2007, 261, 421
-
(2007)
Fluid Phase Equilib.
, vol.261
, pp. 421
-
-
Salminen, J.1
Papaiconomou, N.2
Kumar, R.A.3
Lee, J.-M.4
Kerr, J.5
Newman, J.6
Prausnitz, J.M.7
-
26
-
-
18844402446
-
The Effect of the Anion on the Physical Properties of Trihalide-Based N, N -Dialkylimidazolium Ionic Liquids
-
Bagno, A.; Butts, C.; Chiappe, C.; D'Amico, F.; Lord, J. C. D.; Pieraccini, D.; Rastrelli, F. The Effect of the Anion on the Physical Properties of Trihalide-Based N, N -Dialkylimidazolium Ionic Liquids Org. Biomol. Chem. 2005, 3, 1624
-
(2005)
Org. Biomol. Chem.
, vol.3
, pp. 1624
-
-
Bagno, A.1
Butts, C.2
Chiappe, C.3
D'Amico, F.4
Lord, J.C.D.5
Pieraccini, D.6
Rastrelli, F.7
-
27
-
-
33644766490
-
Characterization and Comparison of Hydrophilic and Hydrophobic Room Temperature Ionic Liquids Incorporating the Imidazolium Cation
-
Huddleston, J. G.; Visser, A. E.; Reichert, W. M.; Willauer, H. D.; Broker, G. A.; Rogers, R. D. Characterization and Comparison of Hydrophilic and Hydrophobic Room Temperature Ionic Liquids Incorporating the Imidazolium Cation Green Chem. 2001, 3, 156
-
(2001)
Green Chem.
, vol.3
, pp. 156
-
-
Huddleston, J.G.1
Visser, A.E.2
Reichert, W.M.3
Willauer, H.D.4
Broker, G.A.5
Rogers, R.D.6
-
28
-
-
7544241270
-
Physicochemical Properties and Structures of Room Temperature Ionic Liquids. 1. Variation of Anionic Species
-
Tokuda, H.; Hayamizu, K.; Ishii, K.; Susan, M. A. B. H.; Watanabe, M. Physicochemical Properties and Structures of Room Temperature Ionic Liquids. 1. Variation of Anionic Species J. Phys. Chem. B 2004, 108, 16593
-
(2004)
J. Phys. Chem. B
, vol.108
, pp. 16593
-
-
Tokuda, H.1
Hayamizu, K.2
Ishii, K.3
Susan, M.A.B.H.4
Watanabe, M.5
-
29
-
-
23044444096
-
New Ionic Liquids with Tris(perfluoroalkyl)trifluorophosphate (FAP) Anions
-
Ignatev, N. V.; Welz-Biermann, U.; Kucheryna, A.; Bissky, G.; Willner, H. New Ionic Liquids with Tris(perfluoroalkyl)trifluorophosphate (FAP) Anions J. Fluorine Chem. 2005, 126, 1150
-
(2005)
J. Fluorine Chem.
, vol.126
, pp. 1150
-
-
Ignatev, N.V.1
Welz-Biermann, U.2
Kucheryna, A.3
Bissky, G.4
Willner, H.5
-
31
-
-
80055045849
-
A New Force Field Model of 1-Butyl-3-methylimidazolium Tetrafluoroborate Ionic Liquid and Acetonitrile Mixtures
-
Chaban, V. V.; Prezhdo, O. V. A New Force Field Model of 1-Butyl-3-methylimidazolium Tetrafluoroborate Ionic Liquid and Acetonitrile Mixtures Phys. Chem. Chem. Phys. 2011, 13, 19345
-
(2011)
Phys. Chem. Chem. Phys.
, vol.13
, pp. 19345
-
-
Chaban, V.V.1
Prezhdo, O.V.2
-
32
-
-
84863612319
-
Acetonitrile Boosts Conductivity of Imidazolium Ionic Liquids
-
Chaban, V. V.; Voroshylova, I. V.; Kalugin, O. N.; Prezhdo, O. V. Acetonitrile Boosts Conductivity of Imidazolium Ionic Liquids J. Phys. Chem. B 2012, 116, 7719
-
(2012)
J. Phys. Chem. B
, vol.116
, pp. 7719
-
-
Chaban, V.V.1
Voroshylova, I.V.2
Kalugin, O.N.3
Prezhdo, O.V.4
-
33
-
-
79956044480
-
A New Force Field Model for the Simulation of Transport Properties of Imidazolium-Based Ionic Liquids
-
Chaban, V. V.; Voroshylova, I. V.; Kalugin, O. N. A New Force Field Model for the Simulation of Transport Properties of Imidazolium-Based Ionic Liquids Phys. Chem. Chem. Phys. 2011, 13, 7910
-
(2011)
Phys. Chem. Chem. Phys.
, vol.13
, pp. 7910
-
-
Chaban, V.V.1
Voroshylova, I.V.2
Kalugin, O.N.3
-
34
-
-
84872193684
-
Theoretical Deconstruction of the X-ray Structure Function Exposes Polarity Alternations in Room Temperature Ionic Liquids
-
Kashyap, H. K.; Margulis, C. J. Theoretical Deconstruction of the X-ray Structure Function Exposes Polarity Alternations in Room Temperature Ionic Liquids ECS Trans. 2012, 50, 301
-
(2012)
ECS Trans.
, vol.50
, pp. 301
-
-
Kashyap, H.K.1
Margulis, C.J.2
-
35
-
-
79551649066
-
Role of Cation Symmetry in Intermolecular Structure and Dynamics of Room Temperature Ionic Liquids: Simulation Studies
-
Raju, S. G.; Balasubramanian, S. Role of Cation Symmetry in Intermolecular Structure and Dynamics of Room Temperature Ionic Liquids: Simulation Studies J. Phys. Chem. B 2010, 114, 6455
-
(2010)
J. Phys. Chem. B
, vol.114
, pp. 6455
-
-
Raju, S.G.1
Balasubramanian, S.2
-
36
-
-
84855461898
-
Mesoscopic Structural Heterogeneities in Room-Temperature Ionic Liquids
-
Russina, O.; Triolo, A.; Gontrani, L.; Caminiti, R. Mesoscopic Structural Heterogeneities in Room-Temperature Ionic Liquids J. Phys. Chem. Lett. 2012, 3, 27
-
(2012)
J. Phys. Chem. Lett.
, vol.3
, pp. 27
-
-
Russina, O.1
Triolo, A.2
Gontrani, L.3
Caminiti, R.4
-
37
-
-
34249707266
-
Nanoscale Segregation in Room Temperature Ionic Liquids
-
Triolo, A.; Russina, O.; Bleif, H.-J.; Di Cola, E. Nanoscale Segregation in Room Temperature Ionic Liquids J. Phys. Chem. B 2007, 111, 4641
-
(2007)
J. Phys. Chem. B
, vol.111
, pp. 4641
-
-
Triolo, A.1
Russina, O.2
Bleif, H.-J.3
Di Cola, E.4
-
38
-
-
43749102046
-
Morphology of 1-Alkyl-3-methylimidazolium Hexafluorophosphate Room Temperature Ionic Liquids
-
Triolo, A.; Russina, O.; Fazio, B.; Triolo, R.; Di Cola, E. Morphology of 1-Alkyl-3-methylimidazolium Hexafluorophosphate Room Temperature Ionic Liquids Chem. Phys. Lett. 2008, 457, 362
-
(2008)
Chem. Phys. Lett.
, vol.457
, pp. 362
-
-
Triolo, A.1
Russina, O.2
Fazio, B.3
Triolo, R.4
Di Cola, E.5
-
40
-
-
33748778211
-
Nonpolar, Polar, and Associating Solutes in Ionic Liquids
-
Canongia Lopes, J. N.; Costa Gomes, M. F.; Padua, A. A. H. Nonpolar, Polar, and Associating Solutes in Ionic Liquids J. Phys. Chem. B 2006, 110, 16816
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 16816
-
-
Canongia Lopes, J.N.1
Costa Gomes, M.F.2
Padua, A.A.H.3
-
41
-
-
0036198608
-
Small-Angle X-ray Scattering Studies of Liquid Crystalline 1-Alkyl-3-methylimidazolium Salts
-
Bradley, A. E.; Hardacre, C.; Holbrey, J. D.; Johnston, S.; McMath, S. E. J.; Nieuwenhuyzen, M. Small-Angle X-ray Scattering Studies of Liquid Crystalline 1-Alkyl-3-methylimidazolium Salts Chem. Mater. 2002, 14, 629
-
(2002)
Chem. Mater.
, vol.14
, pp. 629
-
-
Bradley, A.E.1
Hardacre, C.2
Holbrey, J.D.3
Johnston, S.4
McMath, S.E.J.5
Nieuwenhuyzen, M.6
-
42
-
-
33644902649
-
Microscopic Structure and Solvation in Dry and Wet Octanol
-
Chen, B.; Siepmann, J. I. Microscopic Structure and Solvation in Dry and Wet Octanol J. Phys. Chem. B 2006, 110, 3555
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 3555
-
-
Chen, B.1
Siepmann, J.I.2
-
43
-
-
82455206259
-
New Experimental Evidence Supporting the Mesoscopic Segregation Model in Room Temperature Ionic Liquids
-
Russina, O.; Triolo, A. New Experimental Evidence Supporting the Mesoscopic Segregation Model in Room Temperature Ionic Liquids Faraday Discuss. 2012, 154, 97
-
(2012)
Faraday Discuss.
, vol.154
, pp. 97
-
-
Russina, O.1
Triolo, A.2
-
44
-
-
24644486893
-
Unique Spatial Heterogeneity in Ionic Liquids
-
Wang, Y.; Voth, G. A. Unique Spatial Heterogeneity in Ionic Liquids J. Am. Chem. Soc. 2005, 127, 12192
-
(2005)
J. Am. Chem. Soc.
, vol.127
, pp. 12192
-
-
Wang, Y.1
Voth, G.A.2
-
45
-
-
33749618633
-
Tail Aggregation and Domain Diffusion in Ionic Liquids
-
Wang, Y.; Voth, G. A. Tail Aggregation and Domain Diffusion in Ionic Liquids J. Phys. Chem. B 2006, 110, 18601
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 18601
-
-
Wang, Y.1
Voth, G.A.2
-
46
-
-
34249716260
-
Molecular Dynamics Simulation of Nanostructural Organization in Ionic Liquid/Water Mixtures
-
Jiang, W.; Wang, Y.; Voth, G. A. Molecular Dynamics Simulation of Nanostructural Organization in Ionic Liquid/Water Mixtures J. Phys. Chem. B 2007, 111, 4812
-
(2007)
J. Phys. Chem. B
, vol.111
, pp. 4812
-
-
Jiang, W.1
Wang, Y.2
Voth, G.A.3
-
47
-
-
37349025457
-
Understanding Ionic Liquids through Atomistic and Coarse-Grained Molecular Dynamics Simulations
-
Wang, Y.; Jiang, W.; Yan, T.; Voth, G. A. Understanding Ionic Liquids through Atomistic and Coarse-Grained Molecular Dynamics Simulations Acc. Chem. Res. 2007, 40, 1193
-
(2007)
Acc. Chem. Res.
, vol.40
, pp. 1193
-
-
Wang, Y.1
Jiang, W.2
Yan, T.3
Voth, G.A.4
-
48
-
-
84860378453
-
SAXS Anti-peaks Reveal the Length-Scales of Dual Positive-Negative and Polar-Apolar Ordering in Room-Temperature Ionic Liquids
-
Kashyap, H. K.; Hettige, J. J.; Annapureddy, H. V. R.; Margulis, C. J. SAXS Anti-peaks Reveal the Length-Scales of Dual Positive-Negative and Polar-Apolar Ordering in Room-Temperature Ionic Liquids Chem. Commun. 2012, 48, 5103
-
(2012)
Chem. Commun.
, vol.48
, pp. 5103
-
-
Kashyap, H.K.1
Hettige, J.J.2
Annapureddy, H.V.R.3
Margulis, C.J.4
-
49
-
-
78650370385
-
What is the Origin of the Prepeak in the X-ray Scattering of Imidazolium-Based Room-Temperature Ionic Liquids?
-
Annapureddy, H. V. R.; Kashyap, H. K.; De Biase, P. M.; Margulis, C. J. What is the Origin of the Prepeak in the X-ray Scattering of Imidazolium-Based Room-Temperature Ionic Liquids? J. Phys. Chem. B 2010, 114, 16838
-
(2010)
J. Phys. Chem. B
, vol.114
, pp. 16838
-
-
Annapureddy, H.V.R.1
Kashyap, H.K.2
De Biase, P.M.3
Margulis, C.J.4
-
50
-
-
82455174367
-
Temperature-Dependent Structure of Ionic Liquids: X-ray Scattering and Simulations
-
Kashyap, H. K.; Santos, C. S.; Annapureddy, H. V. R.; Murthy, N. S.; Margulis, C. J.; Castner, E. W., Jr. Temperature-Dependent Structure of Ionic Liquids: X-ray Scattering and Simulations Faraday Discuss. 2012, 154, 133
-
(2012)
Faraday Discuss.
, vol.154
, pp. 133
-
-
Kashyap, H.K.1
Santos, C.S.2
Annapureddy, H.V.R.3
Murthy, N.S.4
Margulis, C.J.5
Castner Jr., E.W.6
-
51
-
-
67650072736
-
Liquid Structure of Trihexyltetradecylphosphonium Chloride at Ambient Temperature: An X-ray Scattering and Simulation Study
-
Gontrani, L.; Russina, O.; Celso, F. L.; 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
-
(2009)
J. Phys. Chem. B
, vol.113
, pp. 9235
-
-
Gontrani, L.1
Russina, O.2
Celso, F.L.3
Caminiti, R.4
Annat, G.5
Triolo, A.6
-
52
-
-
78650099286
-
Structural Properties of 1-Alkyl-3-methylimidazolium Bis{(trifluoromethyl)sulfonyl}amide Ionic Liquids: X-ray Diffraction Data and Molecular Dynamics Simulations
-
Bodo, E.; Gontrani, L.; Caminiti, R.; Plechkova, N. V.; Seddon, K. R.; Triolo, A. Structural Properties of 1-Alkyl-3-methylimidazolium Bis{(trifluoromethyl)sulfonyl}amide Ionic Liquids: X-ray Diffraction Data and Molecular Dynamics Simulations J. Phys. Chem. B 2010, 114, 16398
-
(2010)
J. Phys. Chem. B
, vol.114
, pp. 16398
-
-
Bodo, E.1
Gontrani, L.2
Caminiti, R.3
Plechkova, N.V.4
Seddon, K.R.5
Triolo, A.6
-
53
-
-
79958082130
-
Effect of Cation Symmetry on the Morphology and Physicochemical Properties of Imidazolium Ionic Liquids
-
Zheng, W.; Mohammed, A.; Hines, L. G.; Xiao, D.; Martinez, O. J.; Bartsch, R. A.; Simon, S. L.; Russina, O.; Triolo, A.; Quitevis, E. L. Effect of Cation Symmetry on the Morphology and Physicochemical Properties of Imidazolium Ionic Liquids J. Phys. Chem. B 2011, 115, 6572
-
(2011)
J. Phys. Chem. B
, vol.115
, pp. 6572
-
-
Zheng, W.1
Mohammed, A.2
Hines, L.G.3
Xiao, D.4
Martinez, O.J.5
Bartsch, R.A.6
Simon, S.L.7
Russina, O.8
Triolo, A.9
Quitevis, E.L.10
-
54
-
-
84855471368
-
Alkyl Chain Length and Temperature Effects on Structural Properties of Pyrrolidinium-Based Ionic Liquids: A Combined Atomistic Simulation and Small-Angle X-ray Scattering Study
-
Li, S.; Banuelos, J. L.; Guo, J.; Anovitz, L.; Rother, G.; Shaw, R. W.; Hillesheim, P. C.; Dai, S.; Baker, G. A.; Cummings, P. T. Alkyl Chain Length and Temperature Effects on Structural Properties of Pyrrolidinium-Based Ionic Liquids: A Combined Atomistic Simulation and Small-Angle X-ray Scattering Study J. Phys. Chem. Lett. 2012, 3, 125
-
(2012)
J. Phys. Chem. Lett.
, vol.3
, pp. 125
-
-
Li, S.1
Banuelos, J.L.2
Guo, J.3
Anovitz, L.4
Rother, G.5
Shaw, R.W.6
Hillesheim, P.C.7
Dai, S.8
Baker, G.A.9
Cummings, P.T.10
-
55
-
-
79953315995
-
Communication: X-ray Scattering from Ionic Liquids with Pyrrolidinium Cations
-
Santos, C. S.; Murthy, N. S.; Baker, G. A.; Castner, E. W., Jr. Communication: X-ray Scattering from Ionic Liquids with Pyrrolidinium Cations J. Chem. Phys. 2011, 134, 121101
-
(2011)
J. Chem. Phys.
, vol.134
, pp. 121101
-
-
Santos, C.S.1
Murthy, N.S.2
Baker, G.A.3
Castner Jr., E.W.4
-
56
-
-
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
-
(2005)
J. Comput. Chem.
, vol.26
, pp. 1701
-
-
Van Der Spoel, D.1
Lindahl, E.2
Hess, B.3
Groenhof, G.4
Mark, A.E.5
Berendsen, H.J.C.6
-
57
-
-
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
-
(2008)
J. Chem. Theory Comput.
, vol.4
, pp. 435
-
-
Hess, B.1
Kutzner, C.2
Van Der Spoel, D.3
Lindahl, E.4
-
58
-
-
33750349101
-
Molecular Force Field for Ionic Liquids III: Imidazolium, Pyridinium, and Phosphonium Cations; Chloride, Bromide, and Dicyanamide Anions
-
Canongia Lopes, J. N.; Padua, 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
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 19586
-
-
Canongia Lopes, J.N.1
Padua, A.A.H.2
-
59
-
-
8344262237
-
Molecular Force Field for Ionic Liquids Composed of Triflate or Bistriflylimide Anions
-
Canongia Lopes, J. N.; Padua, A. A. H. Molecular Force Field for Ionic Liquids Composed of Triflate or Bistriflylimide Anions J. Phys. Chem. B 2004, 108, 16893
-
(2004)
J. Phys. Chem. B
, vol.108
, pp. 16893
-
-
Canongia Lopes, J.N.1
Padua, A.A.H.2
-
60
-
-
1342344772
-
Modeling Ionic Liquids Using a Systematic All-Atom Force Field
-
Canongia Lopes, J. N.; Deschamps, J.; Padua, A. A. H. Modeling Ionic Liquids Using a Systematic All-Atom Force Field J. Phys. Chem. B 2004, 108, 2038
-
(2004)
J. Phys. Chem. B
, vol.108
, pp. 2038
-
-
Canongia Lopes, J.N.1
Deschamps, J.2
Padua, A.A.H.3
-
61
-
-
84943502952
-
A Molecular Dynamics Method for Simulations in the Canonical Ensemble
-
Nose, S. A Molecular Dynamics Method for Simulations in the Canonical Ensemble Mol. Phys.: Int. J. Interface Chem. and Phys. 1984, 52, 255
-
(1984)
Mol. Phys.: Int. J. Interface Chem. and Phys.
, vol.52
, pp. 255
-
-
Nose, S.1
-
62
-
-
34547809547
-
A Unified Formulation of the Constant Temperature Molecular Dynamics Methods
-
Nose, S. A Unified Formulation of the Constant Temperature Molecular Dynamics Methods J. Chem. Phys. 1984, 81, 511
-
(1984)
J. Chem. Phys.
, vol.81
, pp. 511
-
-
Nose, S.1
-
63
-
-
0019707626
-
Polymorphic Transitions in Single Crystals: A New Molecular Dynamics Method
-
Parrinello, M.; Rahman, A. Polymorphic Transitions in Single Crystals: A New Molecular Dynamics Method J. Appl. Phys. 1981, 52, 7182
-
(1981)
J. Appl. Phys.
, vol.52
, pp. 7182
-
-
Parrinello, M.1
Rahman, A.2
-
64
-
-
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
-
(1995)
J. Chem. Phys.
, vol.103
, pp. 8577
-
-
Essmann, U.1
Perera, L.2
Berkowitz, M.L.3
Darden, T.4
Lee, H.5
Pedersen, L.G.6
-
65
-
-
33846823909
-
Particle Mesh Ewald: An N log(N) Method for Ewald Sums in Large Systems
-
Darden, T.; York, D.; Pedersen, L. Particle Mesh Ewald: An N log(N) Method for Ewald Sums in Large Systems J. Chem. Phys. 1993, 98, 10089
-
(1993)
J. Chem. Phys.
, vol.98
, pp. 10089
-
-
Darden, T.1
York, D.2
Pedersen, L.3
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