메뉴 건너뛰기




Volumn 118, Issue 2, 2014, Pages 864-872

Screening methodology for the efficient pairing of ionic liquids and carbonaceous electrodes applied to electric energy storage

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION ENERGIES; DESOLVATION ENERGY; DISSOCIATION ENERGIES; ELECTRIC CAPACITANCE; ELECTRODE PORES; INDIVIDUAL ION; PORE DIAMETERS; TOTAL CHARGE;

EID: 84892707797     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp409995q     Document Type: Article
Times cited : (17)

References (44)
  • 1
    • 54949139227 scopus 로고    scopus 로고
    • Materials for Electrochemical Capacitors
    • Simon, P.; Gogotsi, Y. Materials for Electrochemical Capacitors Nat. Mater. 2008, 7, 845-854
    • (2008) Nat. Mater. , vol.7 , pp. 845-854
    • Simon, P.1    Gogotsi, Y.2
  • 2
    • 0035479805 scopus 로고    scopus 로고
    • Studies and Characterisations of Various Activated Carbons Used for Carbon/Carbon Supercapacitors
    • Gamby, J.; Taberna, P. L.; Simon, P.; Fauvarque, J. F.; Chesneau, M. Studies and Characterisations of Various Activated Carbons Used for Carbon/Carbon Supercapacitors J. Power Sources 2001, 101, 109-116
    • (2001) J. Power Sources , vol.101 , pp. 109-116
    • Gamby, J.1    Taberna, P.L.2    Simon, P.3    Fauvarque, J.F.4    Chesneau, M.5
  • 3
    • 84865129290 scopus 로고    scopus 로고
    • Coconut-Shell-Based Porous Carbons with a Tunable Micro/Mesopore Ratio for High-Performance Supercapacitors
    • Mi, J.; Wang, X.-R.; Fan, R.-J.; Qu, W.-H.; Li, W.-C. Coconut-Shell-Based Porous Carbons with a Tunable Micro/Mesopore Ratio for High-Performance Supercapacitors Energy Fuels 2012, 26, 5321-5329
    • (2012) Energy Fuels , vol.26 , pp. 5321-5329
    • Mi, J.1    Wang, X.-R.2    Fan, R.-J.3    Qu, W.-H.4    Li, W.-C.5
  • 4
    • 33749007675 scopus 로고    scopus 로고
    • Anomalous Increase in Carbon Capacitance at Pore Sizes Less Than 1 Nanometer
    • Chmiola, J.; Yushin, G.; Gogotsi, Y.; Portet, C.; Simon, P.; Taberna, P.-L. Anomalous Increase in Carbon Capacitance at Pore Sizes Less Than 1 Nanometer Science 2006, 313, 1760-1763
    • (2006) Science , vol.313 , pp. 1760-1763
    • Chmiola, J.1    Yushin, G.2    Gogotsi, Y.3    Portet, C.4    Simon, P.5    Taberna, P.-L.6
  • 5
    • 53549104145 scopus 로고    scopus 로고
    • Desolvation of Ions in Subnanometer Pores and Its Effect on Capacitance and Double-Layer Theory
    • Chmiola, J.; Largeot, C.; Taberna, P.-L.; Simon, P.; Gogotsi, Y. Desolvation of Ions in Subnanometer Pores and Its Effect on Capacitance and Double-Layer Theory Angew. Chem., Int. Ed. 2008, 47, 3392-3395
    • (2008) Angew. Chem., Int. Ed. , vol.47 , pp. 3392-3395
    • Chmiola, J.1    Largeot, C.2    Taberna, P.-L.3    Simon, P.4    Gogotsi, Y.5
  • 6
    • 40949121029 scopus 로고    scopus 로고
    • Relation between the Ion Size and Pore Size for an Electric Double-Layer Capacitor
    • Largeot, C.; Portet, C.; Chmiola, J.; Taberna, P.-L.; Gogotsi, Y.; Simon, P. Relation Between the Ion Size and Pore Size for an Electric Double-Layer Capacitor J. Am. Chem. Soc. 2008, 130, 2730-2731
    • (2008) J. Am. Chem. Soc. , vol.130 , pp. 2730-2731
    • Largeot, C.1    Portet, C.2    Chmiola, J.3    Taberna, P.-L.4    Gogotsi, Y.5    Simon, P.6
  • 7
    • 84855662169 scopus 로고    scopus 로고
    • Steric Effects in Adsorption of Ions from Mixed Electrolytes into Microporous Carbon
    • Segalini, J.; Iwama, E.; Taberna, P.-L.; Gogotsi, Y.; Simon, P. Steric Effects in Adsorption of Ions from Mixed Electrolytes into Microporous Carbon Electrochem. Commun. 2012, 15, 63-65
    • (2012) Electrochem. Commun. , vol.15 , pp. 63-65
    • Segalini, J.1    Iwama, E.2    Taberna, P.-L.3    Gogotsi, Y.4    Simon, P.5
  • 8
    • 40949155769 scopus 로고    scopus 로고
    • Theoretical Model for Nanoporous Carbon Supercapacitors
    • Huang, J.; Sumpter, B. G.; Meunier, V. Theoretical Model for Nanoporous Carbon Supercapacitors Angew. Chem., Int. Ed. 2008, 47, 520-524
    • (2008) Angew. Chem., Int. Ed. , vol.47 , pp. 520-524
    • Huang, J.1    Sumpter, B.G.2    Meunier, V.3
  • 9
    • 84885152241 scopus 로고    scopus 로고
    • Molecular Insights into Carbon Supercapacitors Based on Room Temperature Ionic Liquids
    • Feng, G.; Li, S.; Presser, V.; Cummings, P. T. Molecular Insights into Carbon Supercapacitors Based on Room Temperature Ionic Liquids J. Phys. Chem. Lett. 2013, 4, 3367-3376
    • (2013) J. Phys. Chem. Lett. , vol.4 , pp. 3367-3376
    • Feng, G.1    Li, S.2    Presser, V.3    Cummings, P.T.4
  • 10
    • 77951746288 scopus 로고    scopus 로고
    • Nanoporous Carbon Supercapacitors in an Ionic Liquid: A Computer Simulation Study
    • Shim, Y.; Kim, H. J. Nanoporous Carbon Supercapacitors in an Ionic Liquid: A Computer Simulation Study ACS Nano 2010, 4, 2345-2355
    • (2010) ACS Nano , vol.4 , pp. 2345-2355
    • Shim, Y.1    Kim, H.J.2
  • 11
    • 69349100875 scopus 로고    scopus 로고
    • Molecular Simulation of Electric Double-Layer Capacitors Based on Carbon Nanotube Forests
    • Yang, L.; Fishbine, B. H.; Migliori, A.; Pratt, L. R. Molecular Simulation of Electric Double-Layer Capacitors Based on Carbon Nanotube Forests J. Am. Chem. Soc. 2009, 131, 12373-12376
    • (2009) J. Am. Chem. Soc. , vol.131 , pp. 12373-12376
    • Yang, L.1    Fishbine, B.H.2    Migliori, A.3    Pratt, L.R.4
  • 13
    • 1342344772 scopus 로고    scopus 로고
    • 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, 11250-11250
    • (2004) J. Phys. Chem. B , vol.108 , pp. 11250-11250
    • Canongia Lopes, J.N.1    Deschamps, J.2    Padua, A.A.H.3
  • 14
    • 33750349101 scopus 로고    scopus 로고
    • 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, 19586-19592
    • (2006) J. Phys. Chem. B , vol.110 , pp. 19586-19592
    • Canongia Lopes, J.N.1    Padua, A.A.H.2
  • 15
    • 0037061956 scopus 로고    scopus 로고
    • A Force Field for Liquid State Simulations on Room Temperature Molten Salts: 1-Ethyl-3-methylimidazolium Tetrachloroaluminate
    • Andrade, J.; de Böes, E. S.; Stassen, H. A Force Field for Liquid State Simulations on Room Temperature Molten Salts: 1-Ethyl-3-methylimidazolium Tetrachloroaluminate J. Phys. Chem. B 2002, 106, 3546-3548
    • (2002) J. Phys. Chem. B , vol.106 , pp. 3546-3548
    • Andrade, J.1    De Böes, E.S.2    Stassen, H.3
  • 16
    • 0000722662 scopus 로고    scopus 로고
    • Host-Guest Chemistry of Rotaxanes and Catenanes: Application of a Polarizable All-Atom Force Field to Cyclobis(paraquat-p-phenylene) Complexes with Disubstituted Benzenes and Biphenyls
    • Kaminski, G. A.; Jorgensen, W. L. Host-Guest Chemistry of Rotaxanes and Catenanes: Application of a Polarizable All-Atom Force Field to Cyclobis(paraquat-p-phenylene) Complexes with Disubstituted Benzenes and Biphenyls J. Chem. Soc., Perkin Trans. 2 1999, 2365-2375
    • (1999) J. Chem. Soc., Perkin Trans. 2 , pp. 2365-2375
    • Kaminski, G.A.1    Jorgensen, W.L.2
  • 17
    • 8344262237 scopus 로고    scopus 로고
    • Molecular Force Field for Ionic Liquids Composed of Triflate or Bistriflylimide Anions
    • Canongia Lopes, J. N. Molecular Force Field for Ionic Liquids Composed of Triflate or Bistriflylimide Anions J. Phys. Chem. B 2004, 16893-16898
    • (2004) J. Phys. Chem. B , pp. 16893-16898
    • Canongia Lopes, J.N.1
  • 19
    • 69949118458 scopus 로고    scopus 로고
    • PACKMOL: A Package for Building Initial Configurations for Molecular Dynamics Simulations
    • Martínez, L.; Andrade, R.; Birgin, E. G.; Martínez, J. M. PACKMOL: A Package for Building Initial Configurations for Molecular Dynamics Simulations J. Comput. Chem. 2009, 30, 2157-64
    • (2009) J. Comput. Chem. , vol.30 , pp. 2157-2164
    • Martínez, L.1    Andrade, R.2    Birgin, E.G.3    Martínez, J.M.4
  • 21
  • 22
    • 77957312483 scopus 로고    scopus 로고
    • An Improved Four-Site Ionic Liquid Model
    • Roy, D.; Maroncelli, M. An Improved Four-Site Ionic Liquid Model J. Phys. Chem. B 2010, 114, 12629-12631
    • (2010) J. Phys. Chem. B , vol.114 , pp. 12629-12631
    • Roy, D.1    Maroncelli, M.2
  • 23
    • 0035918762 scopus 로고    scopus 로고
    • Intermolecular Potentials for Simulations of Liquid Imidazolium Salts
    • Hanke, C. G.; Price, S. L.; Lynden-Bell, R. M. Intermolecular Potentials for Simulations of Liquid Imidazolium Salts Mol. Phys. 2001, 99, 801-809
    • (2001) Mol. Phys. , vol.99 , pp. 801-809
    • Hanke, C.G.1    Price, S.L.2    Lynden-Bell, R.M.3
  • 24
    • 57249097736 scopus 로고    scopus 로고
    • Thermodynamic Properties of the Ionic Liquid 1-n-Butyl-3- methylimidazolium Hexafluorophosphate from Monte Carlo Simulations
    • Shah, J. K.; Brennecke, J. F.; Maginn, E. J. Thermodynamic Properties of the Ionic Liquid 1-n-Butyl-3-methylimidazolium Hexafluorophosphate from Monte Carlo Simulations Green Chem. 2002, 4, 112-118
    • (2002) Green Chem. , vol.4 , pp. 112-118
    • Shah, J.K.1    Brennecke, J.F.2    Maginn, E.J.3
  • 27
    • 33751210082 scopus 로고    scopus 로고
    • Molecular Dynamics Simulations of Lithium Alkyl Carbonates
    • Borodin, O.; Smith, G. D.; Fan, P. Molecular Dynamics Simulations of Lithium Alkyl Carbonates J. Phys. Chem. B 2006, 110, 22773-22779
    • (2006) J. Phys. Chem. B , vol.110 , pp. 22773-22779
    • Borodin, O.1    Smith, G.D.2    Fan, P.3
  • 28
    • 33745713390 scopus 로고    scopus 로고
    • 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, 11481-11490
    • (2006) J. Phys. Chem. B , vol.110 , pp. 11481-11490
    • Borodin, O.1    Smith, G.D.2
  • 29
    • 69949185259 scopus 로고    scopus 로고
    • Polarizable Force Field Development and Molecular Dynamics Simulations of Ionic Liquids
    • Borodin, O. Polarizable Force Field Development and Molecular Dynamics Simulations of Ionic Liquids J. Phys. Chem. B 2009, 113, 11463-11478
    • (2009) J. Phys. Chem. B , vol.113 , pp. 11463-11478
    • Borodin, O.1
  • 31
    • 77951100660 scopus 로고    scopus 로고
    • Influence of Polarization on Structural, Thermodynamic, and Dynamic Properties of Ionic Liquids Obtained from Molecular Dynamics Simulations
    • Bedrov, D.; Borodin, O.; Li, Z.; Smith, G. D. Influence of Polarization on Structural, Thermodynamic, and Dynamic Properties of Ionic Liquids Obtained from Molecular Dynamics Simulations J. Phys. Chem. B 2010, 114, 4984-4997
    • (2010) J. Phys. Chem. B , vol.114 , pp. 4984-4997
    • Bedrov, D.1    Borodin, O.2    Li, Z.3    Smith, G.D.4
  • 32
    • 77952702747 scopus 로고    scopus 로고
    • Molecular Dynamics Simulation and Pulsed-Field Gradient NMR Studies of Bis(fluorosulfonyl)imide (FSI) and Bis[(trifluoromethyl)sulfonyl]imide (TFSI)-Based Ionic Liquids
    • Borodin, O.; Gorecki, W.; Smith, G. D.; Armand, M. Molecular Dynamics Simulation and Pulsed-Field Gradient NMR Studies of Bis(fluorosulfonyl)imide (FSI) and Bis[(trifluoromethyl)sulfonyl]imide (TFSI)-Based Ionic Liquids J. Phys. Chem. B 2010, 114, 6786-6798
    • (2010) J. Phys. Chem. B , vol.114 , pp. 6786-6798
    • Borodin, O.1    Gorecki, W.2    Smith, G.D.3    Armand, M.4
  • 33
    • 77958461486 scopus 로고    scopus 로고
    • Molecular Insights into the Potential and Temperature Dependences of the Differential Capacitance of a Room-Temperature Ionic Liquid at Graphite Electrodes
    • Vatamanu, J.; Borodin, O.; Smith, G. D. Molecular Insights into the Potential and Temperature Dependences of the Differential Capacitance of a Room-Temperature Ionic Liquid at Graphite Electrodes J. Am. Chem. Soc. 2010, 132, 14825-14833
    • (2010) J. Am. Chem. Soc. , vol.132 , pp. 14825-14833
    • Vatamanu, J.1    Borodin, O.2    Smith, G.D.3
  • 34
    • 77953943752 scopus 로고    scopus 로고
    • A Comparison of Fluoroalkyl-Derivatized Imidazolium:TFSI and Alkyl-Derivatized Imidazolium:TFSI Ionic Liquids: A Molecular Dynamics Simulation Study
    • Smith, G. D.; Borodin, O.; Magda, J. J.; Boyd, R. H.; Wang, Y.; Bara, J. E.; Miller, S.; Gin, D. L.; Noble, R. D. A Comparison of Fluoroalkyl-Derivatized Imidazolium:TFSI and Alkyl-Derivatized Imidazolium:TFSI Ionic Liquids: A Molecular Dynamics Simulation Study Phys. Chem. Chem. Phys. 2010, 12, 7064-7076
    • (2010) Phys. Chem. Chem. Phys. , vol.12 , pp. 7064-7076
    • Smith, G.D.1    Borodin, O.2    Magda, J.J.3    Boyd, R.H.4    Wang, Y.5    Bara, J.E.6    Miller, S.7    Gin, D.L.8    Noble, R.D.9
  • 35
    • 80052353749 scopus 로고    scopus 로고
    • On the Influence of Surface Topography on the Electric Double Layer Structure and Differential Capacitance of Graphite/Ionic Liquid Interfaces
    • Vatamanu, J.; Cao, L. L.; Borodin, O.; Bedrov, D.; Smith, G. D. On the Influence of Surface Topography on the Electric Double Layer Structure and Differential Capacitance of Graphite/Ionic Liquid Interfaces J. Phys. Chem. Lett. 2011, 2, 2267-2272
    • (2011) J. Phys. Chem. Lett. , vol.2 , pp. 2267-2272
    • Vatamanu, J.1    Cao, L.L.2    Borodin, O.3    Bedrov, D.4    Smith, G.D.5
  • 36
    • 79953043668 scopus 로고    scopus 로고
    • Molecular Simulations of the Electric Double Layer Structure, Differential Capacitance, and Charging Kinetics for N-Methyl-N- propylpyrrolidinium Bis(fluorosulfonyl)imide at Graphite Electrodes
    • Vatamanu, J.; Borodin, O.; Smith, G. D. Molecular Simulations of the Electric Double Layer Structure, Differential Capacitance, and Charging Kinetics for N-Methyl-N-propylpyrrolidinium Bis(fluorosulfonyl)imide at Graphite Electrodes J. Phys. Chem. B 2011, 115, 3073-3084
    • (2011) J. Phys. Chem. B , vol.115 , pp. 3073-3084
    • Vatamanu, J.1    Borodin, O.2    Smith, G.D.3
  • 37
    • 65249111604 scopus 로고    scopus 로고
    • Development of OPLS-AA Force Field Parameters for 68 Unique Ionic Liquids
    • Sambasivarao, S. V; Acevedo, O. Development of OPLS-AA Force Field Parameters for 68 Unique Ionic Liquids J. Chem. Theory Comput. 2009, 5, 1038-1050
    • (2009) J. Chem. Theory Comput. , vol.5 , pp. 1038-1050
    • Sambasivarao, S.V.1    Acevedo, O.2
  • 38
    • 84863229196 scopus 로고    scopus 로고
    • On the Influence of Pore Size and Pore Loading on Structural and Dynamical Heterogeneities of an Ionic Liquid Confined in a Slit Nanopore
    • Rajput, N. N.; Monk, J.; Singh, R.; Hung, F. R. On the Influence of Pore Size and Pore Loading on Structural and Dynamical Heterogeneities of an Ionic Liquid Confined in a Slit Nanopore J. Phys. Chem. C 2012, 116, 5169-5181
    • (2012) J. Phys. Chem. C , vol.116 , pp. 5169-5181
    • Rajput, N.N.1    Monk, J.2    Singh, R.3    Hung, F.R.4
  • 39
    • 84892682616 scopus 로고    scopus 로고
    • version 7.9; Schrödinger, LLC: New York.
    • Jaguar, version 7.9; Schrödinger, LLC: New York, 2012.
    • (2012) Jaguar
  • 42
    • 79952159219 scopus 로고    scopus 로고
    • Carbide-Derived Carbons-From Porous Networks to Nanotubes and Graphene
    • Presser, V.; Heon, M.; Gogotsi, Y. Carbide-Derived Carbons-From Porous Networks to Nanotubes and Graphene Adv. Funct. Mater. 2011, 21, 810-833
    • (2011) Adv. Funct. Mater. , vol.21 , pp. 810-833
    • Presser, V.1    Heon, M.2    Gogotsi, Y.3
  • 44
    • 84858971620 scopus 로고    scopus 로고
    • Effect of Pore Size and Its Dispersity on the Energy Storage in Nanoporous Supercapacitors
    • Kondrat, S.; Pérez, C. R.; Presser, V.; Gogotsi, Y.; Kornyshev, A. A. Effect of Pore Size and Its Dispersity on the Energy Storage in Nanoporous Supercapacitors Energy Environ. Sci. 2012, 5, 6474-6479
    • (2012) Energy Environ. Sci. , vol.5 , pp. 6474-6479
    • Kondrat, S.1    Pérez, C.R.2    Presser, V.3    Gogotsi, Y.4    Kornyshev, A.A.5


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.