Ion Dynamics: Wired-up water

Autor(en)

David Chandler, Christoph Dellago, Phillip L. Geissler

Abstrakt

The splitting of water molecules into protons and hydroxide ions, and their recombination, occurs by proton transfer along hydrogen-bond wires. Now, first principle simulations of the recombination reaction reveal new atomic-scale details of the process showing that compression of the wire plays an important role.

Organisation(en)

Computergestützte Physik und Physik der Weichen Materie

Externe Organisation(en)

University of California, Berkeley

Journal

Nature Chemistry

Band

4

Seiten

245-247

Anzahl der Seiten

3

ISSN

1755-4330

DOI

https://doi.org/10.1038/nchem.1300

Publikationsdatum

2012

Peer-reviewed

Ja

ÖFOS 2012

103036 Theoretische Physik

Link zum Portal

https://ucrisportal.univie.ac.at/de/publications/115b14a8-9f37-49a5-9029-64fdbfb93253