Cargando…

Modeling on Fragmentation of Clusters inside a Mass Spectrometer

[Image: see text] Atmospheric clusters are weakly bound and can fragment inside the measuring instruments, in particular, mass spectrometers. Since the clusters accelerate under electric fields, the fragmentation cannot be described in terms of rate constants under equilibrium conditions. Using basi...

Descripción completa

Detalles Bibliográficos
Autores principales: Zapadinsky, Evgeni, Passananti, Monica, Myllys, Nanna, Kurtén, Theo, Vehkamäki, Hanna
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2018
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6340130/
https://www.ncbi.nlm.nih.gov/pubmed/30550283
http://dx.doi.org/10.1021/acs.jpca.8b10744
_version_ 1783388744472068096
author Zapadinsky, Evgeni
Passananti, Monica
Myllys, Nanna
Kurtén, Theo
Vehkamäki, Hanna
author_facet Zapadinsky, Evgeni
Passananti, Monica
Myllys, Nanna
Kurtén, Theo
Vehkamäki, Hanna
author_sort Zapadinsky, Evgeni
collection PubMed
description [Image: see text] Atmospheric clusters are weakly bound and can fragment inside the measuring instruments, in particular, mass spectrometers. Since the clusters accelerate under electric fields, the fragmentation cannot be described in terms of rate constants under equilibrium conditions. Using basic statistical principles, we have developed a model for fragmentation of clusters moving under an external force. The model describes an energy transfer to the cluster internal modes caused by collisions with residual carrier gas molecules. As soon as enough energy is accumulated in the cluster internal modes, it can fragment. The model can be used for interpreting experimental measurements by atmospheric pressure interface mass spectrometers.
format Online
Article
Text
id pubmed-6340130
institution National Center for Biotechnology Information
language English
publishDate 2018
publisher American Chemical Society
record_format MEDLINE/PubMed
spelling pubmed-63401302019-01-22 Modeling on Fragmentation of Clusters inside a Mass Spectrometer Zapadinsky, Evgeni Passananti, Monica Myllys, Nanna Kurtén, Theo Vehkamäki, Hanna J Phys Chem A [Image: see text] Atmospheric clusters are weakly bound and can fragment inside the measuring instruments, in particular, mass spectrometers. Since the clusters accelerate under electric fields, the fragmentation cannot be described in terms of rate constants under equilibrium conditions. Using basic statistical principles, we have developed a model for fragmentation of clusters moving under an external force. The model describes an energy transfer to the cluster internal modes caused by collisions with residual carrier gas molecules. As soon as enough energy is accumulated in the cluster internal modes, it can fragment. The model can be used for interpreting experimental measurements by atmospheric pressure interface mass spectrometers. American Chemical Society 2018-12-14 2019-01-17 /pmc/articles/PMC6340130/ /pubmed/30550283 http://dx.doi.org/10.1021/acs.jpca.8b10744 Text en Copyright © 2018 American Chemical Society This is an open access article published under an ACS AuthorChoice License (http://pubs.acs.org/page/policy/authorchoice_termsofuse.html) , which permits copying and redistribution of the article or any adaptations for non-commercial purposes.
spellingShingle Zapadinsky, Evgeni
Passananti, Monica
Myllys, Nanna
Kurtén, Theo
Vehkamäki, Hanna
Modeling on Fragmentation of Clusters inside a Mass Spectrometer
title Modeling on Fragmentation of Clusters inside a Mass Spectrometer
title_full Modeling on Fragmentation of Clusters inside a Mass Spectrometer
title_fullStr Modeling on Fragmentation of Clusters inside a Mass Spectrometer
title_full_unstemmed Modeling on Fragmentation of Clusters inside a Mass Spectrometer
title_short Modeling on Fragmentation of Clusters inside a Mass Spectrometer
title_sort modeling on fragmentation of clusters inside a mass spectrometer
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6340130/
https://www.ncbi.nlm.nih.gov/pubmed/30550283
http://dx.doi.org/10.1021/acs.jpca.8b10744
work_keys_str_mv AT zapadinskyevgeni modelingonfragmentationofclustersinsideamassspectrometer
AT passanantimonica modelingonfragmentationofclustersinsideamassspectrometer
AT myllysnanna modelingonfragmentationofclustersinsideamassspectrometer
AT kurtentheo modelingonfragmentationofclustersinsideamassspectrometer
AT vehkamakihanna modelingonfragmentationofclustersinsideamassspectrometer