The solvent shell structure of aqueous iodide: X-ray absorption spectroscopy and classical, hybrid QM/MM and full quantum molecular dynamics simulations-Reference-Cited by-同舟云学术

The solvent shell structure of aqueous iodide: X-ray absorption spectroscopy and classical, hybrid QM/MM and full quantum molecular dynamics simulations

Published:2010-05 Issue:1-3 Volume:371 Page:24-29
ISSN:0301-0104
Container-title:Chemical Physics
language:en
Short-container-title:Chemical Physics

Author:

Pham V.T.,Tavernelli I.,Milne C.J.,van der Veen R.M.,D’Angelo P.,Bressler Ch.,Chergui M.

Publisher

Elsevier BV

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Reference50 articles.

1. Molecular Mechanism of HCl Acid Ionization in Water: Ab Initio Potential Energy Surfaces and Monte Carlo Simulations

2. Reorientional dynamics of water molecules in anionic hydration shells

3. Solvent Structure, Dynamics, and Ion Mobility in Aqueous Solutions at 25 °C

4. Principles of Selective Ion Transport in Channels and Pumps

5. Structure and dynamics of hydrated ions

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