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Phys Rev Lett. 2017 Mar 10;118(10):103402. doi: 10.1103/PhysRevLett.118.103402. Epub 2017 Mar 10.

Size-Resolved Photoelectron Anisotropy of Gas Phase Water Clusters and Predictions for Liquid Water.

Physical review letters

Sebastian Hartweg, Bruce L Yoder, Gustavo A Garcia, Laurent Nahon, Ruth Signorell

Affiliations

  1. Department of Chemistry and Applied Biosciences, Laboratory of Physical Chemistry, ETH Zürich, Vladimir-Prelog-Weg 2, CH-8093 Zürich, Switzerland.
  2. Synchrotron SOLEIL, L'Orme des Merisiers, Saint Aubin BP 48, 91192 Gif sur Yvette, France.

PMID: 28339280 DOI: 10.1103/PhysRevLett.118.103402

Abstract

We report the first measurements of size-resolved photoelectron angular distributions for the valence orbitals of neutral water clusters with up to 20 molecules. A systematic decrease of the photoelectron anisotropy is found for clusters with up to 5-6 molecules, and most remarkably, convergence of the anisotropy for larger clusters. We suggest the latter to be the result of a local short-range scattering potential that is fully described by a unit of 5-6 molecules. The cluster data and a detailed electron scattering model are used to predict the anisotropy of slow photoelectrons in liquid water. Reasonable agreement with experimental liquid jet data is found.

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