id:"swepub:oai:DiVA.org:kth-143986"
Search: id:"swepub:oai:DiVA.org:kth-143986" > Fragmentation Dynam...
- 1 of 1
- Previous record
- Next record
- To hitlist
- Ha, Dang Trinh (author)
Fragmentation Dynamics of Doubly Charged Methionine Phase
- Article/chapterEnglish2014
Publisher, publication year, extent ...
- 2014-02-11
- American Chemical Society (ACS),2014
- printrdacarrier
Numbers
- LIBRIS-ID:oai:DiVA.org:kth-143986
- https://urn.kb.se/resolve?urn=urn:nbn:se:kth:diva-143986URI
- https://doi.org/10.1021/jp4113238DOI
Supplementary language notes
- Language:English
- Summary in:English
Part of subdatabase
- SwePubSwePub
Classification
Notes
- QC 20140407
- The dependence of the fragmentation of doubly charged gas-phase methionine (C5H11NO2S) on the electronic-state character of the parent ion is studied experimentally by energy-resolved electron ion-ion coincidence spectroscopy. The parent dication electronic states are populated by Auger transitions following site-specific sulfur 2p core ionization. Two fragmentation channels are observed to be strongly dependent on the electronic states with vacancies in weakly bound molecular orbitals. All-electron calculations are applied to assign doubly charged final states of sulfur 2p core ionized methionine. In addition, the Car-Parrinello method is applied to model fragmentation dynamics of doubly charged methionine molecules with various initial temperatures to understand the typical characteristics of the molecular dissociation and partly to support the interpretation of experimental data.
Subject headings and genre
- NATURVETENSKAP Kemi Fysikalisk kemi hsv//swe
- NATURAL SCIENCES Chemical Sciences Physical Chemistry hsv//eng
- Density-Functional Theory
- Molecular-Dynamics
- Coincidence
- Photoionization
Added entries (persons, corporate bodies, meetings, titles ...)
- Wang, Y. (author)
- Alcami, M. (author)
- Itaelae, E. (author)
- Kooser, K. (author)
- Urpeainen, S. (author)
- Huels, Michael A.KTH,Atom- och molekylfysik(Swepub:kth)u16g7z5d (author)
- Kukk, E. (author)
- Martin, F. (author)
- KTHAtom- och molekylfysik (creator_code:org_t)
Related titles
- In:Journal of Physical Chemistry A: American Chemical Society (ACS)118:8, s. 1374-13831089-56391520-5215
Internet link
Find in a library
- Journal of Physical Chemistry A (Search for host publication in LIBRIS)
To the university's database
- 1 of 1
- Previous record
- Next record
- To hitlist
Find more in SwePub
- By the author/editor
- Ha, Dang Trinh
- Wang, Y.
- Alcami, M.
- Itaelae, E.
- Kooser, K.
- Urpeainen, S.
- show more...
- Huels, Michael A ...
- Kukk, E.
- Martin, F.
- show less...
- About the subject
-
- NATURAL SCIENCES
- NATURAL SCIENCES
- and Chemical Science ...
- and Physical Chemist ...
- Articles in the publication
- Journal of Physi ...
- By the university
- Royal Institute of Technology
Search outside SwePub
- Extend your search to:
- Google Book Search
- Google Scholar
Kungliga biblioteket hanterar dina personuppgifter i enlighet med EU:s dataskyddsförordning (2018), GDPR. Läs mer om hur det funkar här.
Så här hanterar KB dina uppgifter vid användning av denna tjänst.
- Copyright © LIBRIS - National Library Systems
- LIBRIS.kb.se
