Short range effective potentials for ionic fluids

Keywords

Coulomb, Ionic bonding, Chemistry, Range (aeronautics), Ion

References

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• The ion pair distribution functions in molten rubidium chlorideEmma Mitchell, P. F. J. Poncet, R. J. Stewart — 1976
• X‐RAY AND NEUTRON DIFFRACTION STUDIES OF MOLTEN ALKALI HALIDESH. A. Levy, P. A. Agron, Μ. A. Bredig — 1960
• Charge ordering and the structure of ionic liquids: screened Coulomb versus Coulomb interionic potentialsAndrew Copestake, Robert Evans — 1982
• Application of the molecular dynamics method to a liquid system with long range forces (Molten NaCl)F. Lantelme, Pierre Turq, B. Quentrec — 1974
• Theory of Fused SaltsFrank H. Stillinger, John G. Kirkwood, Peter J. Wojtowicz — 1960
• Ion‐Pair Theory of Concentrated Electrolytes. I. Basic ConceptsFrank H. Stillinger, Ronald Lovett — 1968
• A comparison of constant energy, constant temperature and constant pressure ensembles in molecular dynamics simulations of atomic liquidsDavid Brown, J. H. R. Clarke — 1984
• Law of Corresponding States for Fused SaltsHarald Reiss, S. W. Mayer, Jeffrey L. Katz — 1961
• Interionic pair potentials in the alkali metal halidesLeslie V. Woodcock — 1974
• Kinetic theory of ideal ionic meltsStuart A. Rice — 1962
• Studies in statistical mechanics of Coulombic systems. I. Equation of state for the restricted primitive modelBjo rn Larsen — 1976
• Thermodynamic and structural properties of liquid ionic salts obtained by Monte Carlo computation. Part 1.—Potassium chlorideLeslie V. Woodcock, K. Singer — 1971
• An Empirical Corresponding States Correlation of Densities and Transport Properties of 1-1 Alkali Metal Molten SaltsR. E. Young, John P. O’Connell — 1971
• Interionic potentials in alkali halides and their use in simulations of the molten saltsM J L Sangster, M. Dixon — 1976
• The partial structure factors of molten cuprous chloride from neutron diffraction measurementsD.I. Page, K. Mika — 1971
• Corresponding-states correlation of properties of ionic meltsDavid J. Adams, Ian R. McDonald — 1975
• Isothermal molecular dynamics calculations for liquid saltsLeslie V. Woodcock — 1971
• Analyse structurale des liquides ioniques KCl et CsCl par diffraction de neutronsJ. Derrien, J. Dupuy — 1975
• X-ray diffraction analysis of molten NaCl near its melting pointHideo Ohno, Kazuo Furukawa — 1981

Cited by

• Molecular simulations of new ammonium-based ionic liquids as environmentally acceptable lubricant oilsAna Catarina Fernandes Mendonça — 2013
• Models and simulations of collective motion in biomimetic robots and bacteriaJoanna Cohen — 2007
• Communication: Shifted forces in molecular dynamics.Søren Toxværd, Jeppe C. Dyre — 2010
• Novel ionic lubricants for amorphous carbon surfaces: molecular modeling of the structure and frictionAna Catarina Fernandes Mendonça, Yu. D. Fomin, Patrice Malfreyt — 2013
• Non-Ewald methods: theory and applications to molecular systemsIkuo Fukuda, Haruki Nakamura — 2012
• Crystallization and melting in the Lennard-Jones system: Equilibration, relaxation, and long-time dynamics of the moving interfaceHarald L. Tepper, W. J. Briels — 2001
• A Modulated Bulk as a Fuzzy Boundary for the Simulation of Long-Ranged Inhomogeneous SystemsJ. C. Gil Montoro, J. L. F. Abascal — 1995
• The Radial Boundary of Polyelectrolyte Solutions Containing Asymmetrical SaltsJ. C. Gil Montoro, J. L. F. Abascal — 1999
• Computer simulations of two dimensional gold nanoparticle arrays: the influence of core geometryKafui A. Tay, Fernando Bresme — 2005
• Long ranged interactions in computer simulations and for quasi-2D systemsMartial Mazars — 2011
• Molecular dynamics studies on zeolites. II: A simple model for silicates applied to anhydrous natrolitePierfranco Demontis, Giuseppe B. Suffritti, Simona Quartieri — 1987
• Computer simulation of the structure and properties of non-crystalline oxidesД. К. Белащенко — 1997
• DL_POLY: Application to molecular simulationWilliam R. Smith, Chin W. Yong, P. Mark Rodger — 2002
• Interactions between sterically stabilized nanoparticles in supercritical fluids: a simulation study.Nikhil Patel, S. A. Egorov — 2007
• DL_POLY_2.0: a general-purpose parallel molecular dynamics simulation package.William R. Smith, Timothy R. Forester — 1996
• Convergence problems of Coulomb and multipole sums in crystalsEvgenii V. Kholopov — 2004
• Examination of reference potentials for the molten Kx(KCl)1−x system by the Percus-Yevick approximationSeichi Naito, Shoji Fukase, R. Takagi — 1987
• Molecular dynamics simulation of microstructure and counterion transport in dry ionic heteropolymersC.H. Wong, Julian H. R. Clarke — 2002
• Atomistic simulations of the solid-liquid transition of 1-ethyl-3-methyl imidazolium bromide ionic liquid.Haijun Feng, Zhou Jian, Yu Qian — 2011
• The influence of concentration and ionic strength on the cluster structure of highly charged electrolyte solutionsJ. L. F. Abascal, Fernando Bresme, Pierre Turq — 1994

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