HOMO and LUMO energy levels of N,N- dinitrophenyl-substituted polar diketopyrrolopyrroles (DPP)
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F00216305%3A26310%2F14%3APU107809" target="_blank" >RIV/00216305:26310/14:PU107809 - isvavai.cz</a>
Result on the web
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DOI - Digital Object Identifier
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Alternative languages
Result language
angličtina
Original language name
HOMO and LUMO energy levels of N,N- dinitrophenyl-substituted polar diketopyrrolopyrroles (DPP)
Original language description
Polar N,N- dinitrophenyl-substituted diketopyrrolopyrroles (DPP) were prepared. The LUMO levels (3.65-3.69 eV) are almost independent of the polar substituents. DFT calculations reveal LUMO exclusively on 2,4-dinitro-phenyl substituents. The energy of LUMO is close to the optimal range for electron donors in BHJ SC. The HOMO is tunable by the character of the polar substituents.
Czech name
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Czech description
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Classification
Type
J<sub>imp</sub> - Article in a specialist periodical, which is included in the Web of Science database
CEP classification
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OECD FORD branch
10403 - Physical chemistry
Result continuities
Project
Result was created during the realization of more than one project. More information in the Projects tab.
Continuities
P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)
Others
Publication year
2014
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Name of the periodical
DYES AND PIGMENTS
ISSN
0143-7208
e-ISSN
1873-3743
Volume of the periodical
2014
Issue of the periodical within the volume
106
Country of publishing house
GB - UNITED KINGDOM
Number of pages
7
Pages from-to
136-142
UT code for WoS article
000336017500020
EID of the result in the Scopus database
2-s2.0-84897102463