Molecular simulations of aqueous electrolyte solubility: 1. The expanded-ensemble osmotic molecular dynamics method for the solution phase.

Molecular simulations of aqueous electrolyte solubility: 1. The expanded-ensemble osmotic molecular dynamics method for the solution phase.

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http://www.wikidata.org/entity/Q51937215
Molecular dynamics study of salt-solution interface: solubility and surface charge of salt in water.Void-induced dissolution in molecular dynamics simulations of NaCl and water.Computational methodology for solubility prediction: Application to the sparingly soluble solutes.Solubility of NaCl in water by molecular simulation revisited.Solvent activity in electrolyte solutions from molecular simulation of the osmotic pressure.Electrolyte pore/solution partitioning by expanded grand canonical ensemble Monte Carlo simulation.Molecular force fields for aqueous electrolytes: SPC/E-compatible charged LJ sphere models and their limitations.Modelling aqueous solubility of sodium chloride in clays at thermodynamic conditions of hydraulic fracturing by molecular simulations.Molecular simulation of aqueous electrolytes: water chemical potential results and Gibbs-Duhem equation consistency tests.Consensus on the solubility of NaCl in water from computer simulations using the chemical potential route.Temperature-dependent solubilities and mean ionic activity coefficients of alkali halides in water from molecular dynamics simulations.Mesoscale simulation of polymer reaction equilibrium: combining dissipative particle dynamics with reaction ensemble Monte Carlo. I. Polydispersed polymer systems.Biomolecular Simulations Under Realistic Macroscopic Salt Conditions.Effect of Surface Tension from MD Simulations on Size-Dependent Deliquescence of NaCl Nanoparticles
P2860

Molecular simulations of aqueous electrolyte solubility: 1. The expanded-ensemble osmotic molecular dynamics method for the solution phase.

Item
http://www.wikidata.org/entity/Q51937215
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2005 nî lūn-bûn
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2005年学术文章
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name
Molecular simulations of aqueo ...... method for the solution phase.
@en
Molecular simulations of aqueo ...... method for the solution phase.
@nl
type
label
Molecular simulations of aqueo ...... method for the solution phase.
@en
Molecular simulations of aqueo ...... method for the solution phase.
@nl
prefLabel
Molecular simulations of aqueo ...... method for the solution phase.
@en
Molecular simulations of aqueo ...... method for the solution phase.
@nl
P1433
P1476
P2093
P304
P31
P356
P407
P433
P478
P50
P577
P5875
P698
P356
P1433
P1476
Molecular simulations of aqueo ...... method for the solution phase.
@en
P2093
P304
P31
P356
P407
P433
P478
P50
P577
P5875
P698