MCDHO model of water: Difference between revisions
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Carl McBride (talk | contribs) (New page: ==References== #[http://dx.doi.org/10.1063/1.1324711 Humberto Saint-Martin, Jorge Hernández-Cobos, Margarita I. Bernal-Uruchurtu, Iván Ortega-Blake and Herman J. C. Berendsen "A mob...) |
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The '''MCDHO''' ('''M'''obile '''C'''harge '''D'''ensities in '''H'''armonic '''O'''scillators) model of [[water]]. | |||
==References== | ==References== | ||
#[http://dx.doi.org/10.1063/1.1324711 Humberto Saint-Martin, Jorge Hernández-Cobos, Margarita I. Bernal-Uruchurtu, Iván Ortega-Blake and Herman J. C. Berendsen "A mobile charge densities in harmonic oscillators (MCDHO) molecular model for numerical simulations: The water–water interaction", Journal of Chemical Physics '''113''' pp. 10899-10912 (2000) ] | #[http://dx.doi.org/10.1063/1.1324711 Humberto Saint-Martin, Jorge Hernández-Cobos, Margarita I. Bernal-Uruchurtu, Iván Ortega-Blake and Herman J. C. Berendsen "A mobile charge densities in harmonic oscillators (MCDHO) molecular model for numerical simulations: The water–water interaction", Journal of Chemical Physics '''113''' pp. 10899-10912 (2000) ] | ||
#[http://dx.doi.org/10.1063/1.1747927 Humberto Saint-Martin, Berk Hess and Herman J. C. Berendsen "An application of flexible constraints in Monte Carlo simulations of the isobaric–isothermal ensemble of liquid water and ice Ih with the polarizable and flexible mobile charge densities in harmonic oscillators model", Journal of Chemical Physics '''120''' pp. 11133-11143 (2004)] | |||
[[category: water]] | [[category: water]] | ||
[[category: models]] | [[category: models]] |
Latest revision as of 15:36, 23 February 2010
The MCDHO (Mobile Charge Densities in Harmonic Oscillators) model of water.
References[edit]
- Humberto Saint-Martin, Jorge Hernández-Cobos, Margarita I. Bernal-Uruchurtu, Iván Ortega-Blake and Herman J. C. Berendsen "A mobile charge densities in harmonic oscillators (MCDHO) molecular model for numerical simulations: The water–water interaction", Journal of Chemical Physics 113 pp. 10899-10912 (2000)
- Humberto Saint-Martin, Berk Hess and Herman J. C. Berendsen "An application of flexible constraints in Monte Carlo simulations of the isobaric–isothermal ensemble of liquid water and ice Ih with the polarizable and flexible mobile charge densities in harmonic oscillators model", Journal of Chemical Physics 120 pp. 11133-11143 (2004)