Journal article 654 views
Ab Initio Molecular Dynamics Calculations versus Quantum-State-Resolved Experiments on CHD3 + Pt(111): New Insights into a Prototypical Gas–Surface Reaction
Francesco Nattino,
Hirokazu Ueta,
Helen Chadwick ,
Maarten E. van Reijzen,
Rainer D. Beck,
Bret Jackson,
Marc C. van Hemert,
Geert-Jan Kroes
The Journal of Physical Chemistry Letters, Volume: 5, Issue: 8, Pages: 1294 - 1299
Swansea University Author: Helen Chadwick
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DOI (Published version): 10.1021/jz500233n
Abstract
Ab Initio Molecular Dynamics Calculations versus Quantum-State-Resolved Experiments on CHD3 + Pt(111): New Insights into a Prototypical Gas–Surface Reaction
Published in: | The Journal of Physical Chemistry Letters |
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ISSN: | 1948-7185 |
Published: |
American Chemical Society (ACS)
2014
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URI: | https://cronfa.swan.ac.uk/Record/cronfa56052 |
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2021-01-29T11:48:09.1606864 v2 56052 2021-01-15 Ab Initio Molecular Dynamics Calculations versus Quantum-State-Resolved Experiments on CHD3 + Pt(111): New Insights into a Prototypical Gas–Surface Reaction 8ff1942a68a875f00d473d51aa4947a1 0000-0003-4119-6903 Helen Chadwick Helen Chadwick true false 2021-01-15 CHEM Journal Article The Journal of Physical Chemistry Letters 5 8 1294 1299 American Chemical Society (ACS) 1948-7185 17 4 2014 2014-04-17 10.1021/jz500233n COLLEGE NANME Chemistry COLLEGE CODE CHEM Swansea University 2021-01-29T11:48:09.1606864 2021-01-15T20:14:45.7408762 Faculty of Science and Engineering School of Engineering and Applied Sciences - Chemistry Francesco Nattino 1 Hirokazu Ueta 2 Helen Chadwick 0000-0003-4119-6903 3 Maarten E. van Reijzen 4 Rainer D. Beck 5 Bret Jackson 6 Marc C. van Hemert 7 Geert-Jan Kroes 8 |
title |
Ab Initio Molecular Dynamics Calculations versus Quantum-State-Resolved Experiments on CHD3 + Pt(111): New Insights into a Prototypical Gas–Surface Reaction |
spellingShingle |
Ab Initio Molecular Dynamics Calculations versus Quantum-State-Resolved Experiments on CHD3 + Pt(111): New Insights into a Prototypical Gas–Surface Reaction Helen Chadwick |
title_short |
Ab Initio Molecular Dynamics Calculations versus Quantum-State-Resolved Experiments on CHD3 + Pt(111): New Insights into a Prototypical Gas–Surface Reaction |
title_full |
Ab Initio Molecular Dynamics Calculations versus Quantum-State-Resolved Experiments on CHD3 + Pt(111): New Insights into a Prototypical Gas–Surface Reaction |
title_fullStr |
Ab Initio Molecular Dynamics Calculations versus Quantum-State-Resolved Experiments on CHD3 + Pt(111): New Insights into a Prototypical Gas–Surface Reaction |
title_full_unstemmed |
Ab Initio Molecular Dynamics Calculations versus Quantum-State-Resolved Experiments on CHD3 + Pt(111): New Insights into a Prototypical Gas–Surface Reaction |
title_sort |
Ab Initio Molecular Dynamics Calculations versus Quantum-State-Resolved Experiments on CHD3 + Pt(111): New Insights into a Prototypical Gas–Surface Reaction |
author_id_str_mv |
8ff1942a68a875f00d473d51aa4947a1 |
author_id_fullname_str_mv |
8ff1942a68a875f00d473d51aa4947a1_***_Helen Chadwick |
author |
Helen Chadwick |
author2 |
Francesco Nattino Hirokazu Ueta Helen Chadwick Maarten E. van Reijzen Rainer D. Beck Bret Jackson Marc C. van Hemert Geert-Jan Kroes |
format |
Journal article |
container_title |
The Journal of Physical Chemistry Letters |
container_volume |
5 |
container_issue |
8 |
container_start_page |
1294 |
publishDate |
2014 |
institution |
Swansea University |
issn |
1948-7185 |
doi_str_mv |
10.1021/jz500233n |
publisher |
American Chemical Society (ACS) |
college_str |
Faculty of Science and Engineering |
hierarchytype |
|
hierarchy_top_id |
facultyofscienceandengineering |
hierarchy_top_title |
Faculty of Science and Engineering |
hierarchy_parent_id |
facultyofscienceandengineering |
hierarchy_parent_title |
Faculty of Science and Engineering |
department_str |
School of Engineering and Applied Sciences - Chemistry{{{_:::_}}}Faculty of Science and Engineering{{{_:::_}}}School of Engineering and Applied Sciences - Chemistry |
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published_date |
2014-04-17T04:10:42Z |
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1763753740246974464 |
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11.037581 |