The hydration structure of the heavy-alkalines Rb+ and Cs+ through molecular dynamics and X-ray absorption spectroscopy: surface clusters and eccentricity-Reference-Cited by-同舟云学术

The hydration structure of the heavy-alkalines Rb+ and Cs+ through molecular dynamics and X-ray absorption spectroscopy: surface clusters and eccentricity

Published:2017 Issue:42 Volume:19 Page:28993-29004
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Caralampio Daniel Z.¹²³⁴,Martínez José M.¹²³⁴,Pappalardo Rafael R.¹²³⁴^ORCID,Marcos Enrique Sánchez¹²³⁴^ORCID

Affiliation:

1. Departmento de Quimica Fisica

2. Universidad de Sevilla

3. 41012-Seville

4. Spain

Abstract

Hydration shells around Rb⁺ and Cs⁺ are not symmetric; the cation and the 1st-shell water mass center are separated by ∼0.4 Å, and this is supported by agreement between the theoretical and experimental EXAFS spectrum.

Funder

Consejería de Economía, Innovación, Ciencia y Empleo, Junta de Andalucía

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2017/CP/C7CP05346K

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