Chemical imaging is a powerful tool for understanding the chemical composition and nature of heterogeneous samples. Recent developments in elemental, vibrational, and mass-spectrometric chemical imaging with high spatial resolution (50–200 nm) and reasonable timescale (a few hours) are capable of providing complementary chemical information about various samples. However, a single technique is insufficient to provide a comprehensive understanding of chemically complex materials. For bulk samples, the combination of different analytical methods and the application of statistical methods for extracting correlated information across different techniques is a well-established and powerful concept. However, combined multivariate analytics of chemical images obtained via different imaging techniques is still in its infancy, hampered by a lack of analytical methodologies for data fusion and analysis. This study demonstrates the application of multivariate statistics to chemical images taken from the same sample via various methods to assist in chemical structure determination.
en
dc.description.sponsorship
Hochschuljubiläumsstiftung der Stadt Wien
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dc.description.sponsorship
TU Wien University Library
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dc.language
English
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dc.language.iso
en
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dc.publisher
Springer Nature
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dc.relation.ispartof
Scientific Reports
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dc.rights.uri
http://creativecommons.org/licenses/by/4.0/
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dc.subject
Atmospheric chemistry
en
dc.subject
Bioanalytical chemistry
en
dc.subject
Imaging studies
en
dc.subject
Surface spectroscopy
en
dc.title
Image-based chemical structure determination
en
dc.type
Article
en
dc.type
Artikel
de
dc.rights.license
Creative Commons Namensnennung 4.0 International
de
dc.rights.license
Creative Commons Attribution 4.0 International
en
dc.contributor.affiliation
National Koranyi Institute of Pulmonology, Budapest, 1121, Hungary
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dc.contributor.affiliation
National Koranyi Institute of Pulmonology, Budapest, 1121, Hungary
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dc.contributor.affiliation
TU Wien, Österreich
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dc.relation.grantno
H-297306/2014
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dc.rights.holder
The Author(s) 2017
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dc.type.category
Original Research Article
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tuw.container.volume
7
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true
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true
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vor
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International Co-publication
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dcterms.isPartOf.title
Scientific Reports
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tuw.publication.orgunit
E164 - Institut für Chemische Technologien und Analytik
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tuw.publisher.doi
10.1038/s41598-017-07041-x
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dc.identifier.articleid
6832
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dc.identifier.eissn
2045-2322
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dc.identifier.libraryid
AC11363015
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dc.description.numberOfPages
11
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dc.identifier.urn
urn:nbn:at:at-ubtuw:3-3103
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0000-0002-4535-5679
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0000-0002-7096-6092
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0000-0001-7707-5746
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0000-0002-0454-5062
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0000-0003-2736-2880
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0000-0002-3007-0734
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tuw.author.orcid
0000-0003-3838-5842
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tuw.author.orcid
0000-0002-3856-6662
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dc.rights.identifier
CC BY 4.0
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dc.rights.identifier
CC BY 4.0
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true
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Publications
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http://purl.org/coar/resource_type/c_2df8fbb1
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open
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with Fulltext
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en
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research article
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Open Access
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crisitem.author.dept
E164 - Institut für Chemische Technologien und Analytik
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E164 - Institut für Chemische Technologien und Analytik
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crisitem.author.dept
E164-02-1 - Forschungsgruppe Prozessanalytik
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E164-50-2 - Fachgruppe Technische Services
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crisitem.author.dept
E057-02 - Fachbereich Universitäre Serviceeinrichtung für Transmissions- Elektronenmikroskopie
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E138-03 - Forschungsbereich Functional and Magnetic Materials
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crisitem.author.dept
National Koranyi Institute of Pulmonology, Budapest, 1121, Hungary
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crisitem.author.dept
National Koranyi Institute of Pulmonology, Budapest, 1121, Hungary