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Atomic collisions in suprafluid helium-nanodroplets: timescales for metal-cluster formation derived from He-density functional theory
Collision times for the coinage metal atoms Cu, Ag and Au in He-droplets are derived from helium density functional theory and molecular dynamics simulations. The strength of the attractive interaction between the metal atoms turns out to be less important than the mass of the propagating metal atom...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Royal Society of Chemistry
2015
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4441260/ https://www.ncbi.nlm.nih.gov/pubmed/25812719 http://dx.doi.org/10.1039/c5cp01110h |
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author | Hauser, Andreas W. Volk, Alexander Thaler, Philipp Ernst, Wolfgang E. |
author_facet | Hauser, Andreas W. Volk, Alexander Thaler, Philipp Ernst, Wolfgang E. |
author_sort | Hauser, Andreas W. |
collection | PubMed |
description | Collision times for the coinage metal atoms Cu, Ag and Au in He-droplets are derived from helium density functional theory and molecular dynamics simulations. The strength of the attractive interaction between the metal atoms turns out to be less important than the mass of the propagating metal atoms. Even for small droplets consisting of a few thousand helium atoms, the collision times are shortest for Cu, followed by Ag and Au, despite the higher binding energy of Au(2) compared to Cu(2). |
format | Online Article Text |
id | pubmed-4441260 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2015 |
publisher | Royal Society of Chemistry |
record_format | MEDLINE/PubMed |
spelling | pubmed-44412602015-05-25 Atomic collisions in suprafluid helium-nanodroplets: timescales for metal-cluster formation derived from He-density functional theory Hauser, Andreas W. Volk, Alexander Thaler, Philipp Ernst, Wolfgang E. Phys Chem Chem Phys Chemistry Collision times for the coinage metal atoms Cu, Ag and Au in He-droplets are derived from helium density functional theory and molecular dynamics simulations. The strength of the attractive interaction between the metal atoms turns out to be less important than the mass of the propagating metal atoms. Even for small droplets consisting of a few thousand helium atoms, the collision times are shortest for Cu, followed by Ag and Au, despite the higher binding energy of Au(2) compared to Cu(2). Royal Society of Chemistry 2015-04-28 2015-03-27 /pmc/articles/PMC4441260/ /pubmed/25812719 http://dx.doi.org/10.1039/c5cp01110h Text en This journal is © The Royal Society of Chemistry 2015 http://creativecommons.org/licenses/by/3.0/ This is an Open Access article distributed under the terms of the Creative Commons Attribution 3.0 Unported License (http://creativecommons.org/licenses/by/3.0/) which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited. |
spellingShingle | Chemistry Hauser, Andreas W. Volk, Alexander Thaler, Philipp Ernst, Wolfgang E. Atomic collisions in suprafluid helium-nanodroplets: timescales for metal-cluster formation derived from He-density functional theory |
title | Atomic collisions in suprafluid helium-nanodroplets: timescales for metal-cluster formation derived from He-density functional theory |
title_full | Atomic collisions in suprafluid helium-nanodroplets: timescales for metal-cluster formation derived from He-density functional theory |
title_fullStr | Atomic collisions in suprafluid helium-nanodroplets: timescales for metal-cluster formation derived from He-density functional theory |
title_full_unstemmed | Atomic collisions in suprafluid helium-nanodroplets: timescales for metal-cluster formation derived from He-density functional theory |
title_short | Atomic collisions in suprafluid helium-nanodroplets: timescales for metal-cluster formation derived from He-density functional theory |
title_sort | atomic collisions in suprafluid helium-nanodroplets: timescales for metal-cluster formation derived from he-density functional theory |
topic | Chemistry |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4441260/ https://www.ncbi.nlm.nih.gov/pubmed/25812719 http://dx.doi.org/10.1039/c5cp01110h |
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