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1. J. Phys.: Condens. Matter 2009, 21 373101
Molecular simulation of ionic liquids: current status and future opportunities
E J Maginn

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http://dx.doi.org/10.1088/0953-8984/21/37/373101

2. J. Phys. Chem. B, 2007, 111 (17), pp 4477–4487
Insights into the Structure and Dynamics of a Room-Temperature Ionic Liquid: Ab Initio Molecular Dynamics Simulation Studies of 1-n-Butyl-3-methylimidazolium Hexafluorophosphate ([bmim] [PF6]) and the [bmim][PF6]−CO2 Mixture
B. L. Bhargava, Balasubramanian

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http://dx.doi.org/10.1021/jp068898n

3. J. Phys. Chem. A, 2009, 113 (10), pp 2127–2135
Computational Studies of Structures and Dynamics of 1,3-Dimethylimidazolim Salt Liquids and their Interfaces Using Polarizable Potential Models
Tsun-Mei Chang

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http://dx.doi.org/10.1021/jp809132w

4. J. Phys. Chem. B, 2009, 113 (31), pp 10641–10649
Molecular Dynamics Simulations of Ionic Liquids: Cation and Anion Dependence of Self-Diffusion Coefficients of Ions
Seiji Tsuzuki*†, Wataru Shinoda†, Hiroaki Saito‡, Masuhiro Mikami†, Hiroyuki Tokuda§ and Masayoshi Watanabe

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http://dx.doi.org/10.1021/jp811128b

5. J. Phys. Chem. B, 2005, 109 (12), pp 5895–5902
Ab Initio Molecular Dynamics Simulation of a Room Temperature Ionic Liquid
Mario G. Del Pópolo,† Ruth M. Lynden-Bell,‡ and Jorge Kohanoff

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http://dx.doi.org/10.1021/jp044414g

6. J. Phys. Chem. B, 2005, 109 (39), pp 18591–18599
Ab Initio Molecular Dynamics of Liquid 1,3-Dimethylimidazolium Chloride
Michael Bühl,*† Alain Chaumont,‡ Rachel Schurhammer,‡ and Georges Wipff

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http://dx.doi.org/10.1021/jp0518299

7. J. Phys. Chem. B, 2004, 108 (6), pp 2038–2047
Modeling Ionic Liquids Using a Systematic All-Atom Force Field
José N. Canongia Lopes

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http://dx.doi.org/10.1021/jp0362133

8. J. Phys. Chem. B, 2004, 108 (43), pp 16893–16898
Molecular Force Field for Ionic Liquids Composed of Triflate or Bistriflylimide Anions
José N. Canongia Lopes

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http://dx.doi.org/10.1021/jp0476545

9. J. Phys. Chem. B, 2006, 110 (39), pp 19586–19592
Molecular Force Field for Ionic Liquids III: Imidazolium, Pyridinium, and Phosphonium Cations; Chloride, Bromide, and Dicyanamide Anions
José N. Canongia Lopes*† and Agílio A. H. Pádua

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http://dx.doi.org/10.1021/jp063901o

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