DC Field
Value
Language
dc.contributor.author
Hartl, Benedikt
-
dc.contributor.author
Sharma, Shubham
-
dc.contributor.author
Brügner, Oliver
-
dc.contributor.author
Mertens, Stijn F. L.
-
dc.contributor.author
Walter, Michael
-
dc.contributor.author
Kahl, Gerhard
-
dc.date.accessioned
2023-01-19T14:06:09Z
-
dc.date.available
2023-01-19T14:06:09Z
-
dc.date.issued
2020
-
dc.identifier.citation
<div class="csl-bib-body"> <div class="csl-entry">Hartl, B., Sharma, S., Brügner, O., Mertens, S. F. L., Walter, M., &#38; Kahl, G. (2020). Reliable Computational Prediction of the Supramolecular Ordering of Complex Molecules under Electrochemical Conditions. <i>Journal of Chemical Theory and Computation</i>, <i>16</i>(8), 5227–5243. https://doi.org/10.1021/acs.jctc.9b01251</div> </div>
-
dc.identifier.issn
1549-9618
-
dc.identifier.uri
http://hdl.handle.net/20.500.12708/141783
-
dc.language.iso
en
-
dc.publisher
AMER CHEMICAL SOC
-
dc.relation.ispartof
Journal of Chemical Theory and Computation
-
dc.subject
Computer Science Applications
-
dc.subject
Physical and Theoretical Chemistry
-
dc.title
Reliable Computational Prediction of the Supramolecular Ordering of Complex Molecules under Electrochemical Conditions
en
dc.type
Artikel
de
dc.type
Article
en
dc.description.startpage
5227
-
dc.description.endpage
5243
-
dc.type.category
Original Research Article
-
tuw.container.volume
16
-
tuw.container.issue
8
-
tuw.journal.peerreviewed
true
-
tuw.peerreviewed
true
-
tuw.researchTopic.id
M3
-
tuw.researchTopic.id
M1
-
tuw.researchTopic.id
C1
-
tuw.researchTopic.name
Metallic Materials
-
tuw.researchTopic.name
Surfaces and Interfaces
-
tuw.researchTopic.name
Computational Materials Science
-
tuw.researchTopic.value
10
-
tuw.researchTopic.value
40
-
tuw.researchTopic.value
50
-
dcterms.isPartOf.title
Journal of Chemical Theory and Computation
-
tuw.publication.orgunit
E136 - Institut für Theoretische Physik
-
tuw.publication.orgunit
E134-05 - Forschungsbereich Surface Physics
-
tuw.publisher.doi
10.1021/acs.jctc.9b01251
-
dc.identifier.eissn
1549-9626
-
dc.description.numberOfPages
17
-
tuw.author.orcid
0000-0001-7787-4839
-
tuw.author.orcid
0000-0002-5715-0486
-
tuw.author.orcid
0000-0001-6679-2491
-
tuw.author.orcid
0000-0002-4375-4684
-
wb.sci
true
-
wb.sciencebranch
Physik, Astronomie
-
wb.sciencebranch.oefos
1030
-
wb.facultyfocus
Physik der Materie
de
wb.facultyfocus
Physics of Matter
en
wb.facultyfocus.faculty
E130
-
item.languageiso639-1
en
-
item.openairetype
research article
-
item.grantfulltext
restricted
-
item.fulltext
no Fulltext
-
item.cerifentitytype
Publications
-
item.openairecristype
http://purl.org/coar/resource_type/c_2df8fbb1
-
crisitem.author.dept
E136 - Institut für Theoretische Physik
-
crisitem.author.dept
E134 - Institut für Angewandte Physik
-
crisitem.author.dept
E056-12 - Fachbereich ENROL DP
-
crisitem.author.parentorg
E130 - Fakultät für Physik
-
crisitem.author.parentorg
E130 - Fakultät für Physik
-
crisitem.author.parentorg
E056 - Doctoral School
-
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