The structure of aqueous sodium hydroxide solutions: a combined solution x-ray diffraction and simulation study.
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The structure of hyperalkaline aqueous solutions containing high concentrations of gallium--a solution X-ray diffraction and computational study.The role of water in the elastic properties of aluminosilicate zeolites: DFT investigation.Revisiting the hydration structure of aqueous Na.Structure of aqueous NaOH solutions: insights from neural-network-based molecular dynamics simulations.Ab initio molecular dynamics study of an aqueous NaCl solution under an electric field.Solvation shell resolved THz spectra of simple aqua ions - distinct distance- and frequency-dependent contributions of solvation shells.Metal binding motif in the active site of the HDV ribozyme binds divalent and monovalent ions.A first-principles based force-field for Li+ and OH- in ethanolic solution.Structure and dynamics of aqueous solutions from PBE-based first-principles molecular dynamics simulations.Solvation structures of protons and hydroxide ions in water.Ionic diffusion and proton transfer in aqueous solutions of alkali metal salts.Hydration structure of salt solutions from ab initio molecular dynamics.Energetics and diffusion of liquid water and hydrated ions through nanopores in graphene: ab initio molecular dynamics simulation.Boundary based on exchange symmetry theory for multilevel simulations. II. Multiple time scale approach.A statistical mechanical theory of proton transport kinetics in hydrogen-bonded networks based on population correlation functions with applications to acids and bases.Thermodynamics of hydronium and hydroxide surface solvation
P2860
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P2860
The structure of aqueous sodium hydroxide solutions: a combined solution x-ray diffraction and simulation study.
description
2008 nî lūn-bûn
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2008年の論文
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2008年学术文章
@wuu
2008年学术文章
@zh
2008年学术文章
@zh-cn
2008年学术文章
@zh-hans
2008年学术文章
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2008年学术文章
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2008年學術文章
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2008年學術文章
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name
The structure of aqueous sodiu ...... fraction and simulation study.
@en
The structure of aqueous sodiu ...... fraction and simulation study.
@nl
type
label
The structure of aqueous sodiu ...... fraction and simulation study.
@en
The structure of aqueous sodiu ...... fraction and simulation study.
@nl
prefLabel
The structure of aqueous sodiu ...... fraction and simulation study.
@en
The structure of aqueous sodiu ...... fraction and simulation study.
@nl
P2093
P2860
P356
P1476
The structure of aqueous sodiu ...... fraction and simulation study.
@en
P2093
Szabolcs Bálint
Tamás Grósz
Tamás Radnai
Tünde Megyes
P2860
P304
P356
10.1063/1.2821956
P407
P50
P577
2008-01-01T00:00:00Z