Aggregate Formation of Boron-Containing Molecules in Thermal Vacuum Deposited Films

The spectral properties of new boron-containing dyes were studied. One-component (pure dyes) and composite “Alq<sub>3</sub>+dye” thin films were fabricated using the thermal vacuum deposition method. The positions of the transmission spectra maxima in a one-component film are different f...

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Main Authors: Oleksandr Navozenko, Valeriy Yashchuk, Oleksiy Kachkovsky, Dalius Gudeika, Rita Butkute, Yuriy Slominskii, Volodymyr Azovskyi
Format: Article
Language:English
Published: MDPI AG 2021-09-01
Series:Materials
Subjects:
Online Access:https://www.mdpi.com/1996-1944/14/19/5615
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author Oleksandr Navozenko
Valeriy Yashchuk
Oleksiy Kachkovsky
Dalius Gudeika
Rita Butkute
Yuriy Slominskii
Volodymyr Azovskyi
author_facet Oleksandr Navozenko
Valeriy Yashchuk
Oleksiy Kachkovsky
Dalius Gudeika
Rita Butkute
Yuriy Slominskii
Volodymyr Azovskyi
author_sort Oleksandr Navozenko
collection DOAJ
description The spectral properties of new boron-containing dyes were studied. One-component (pure dyes) and composite “Alq<sub>3</sub>+dye” thin films were fabricated using the thermal vacuum deposition method. The positions of the transmission spectra maxima in a one-component film are different for different film thicknesses. The best correlation of the maxima positions of the dye transmission spectra in solid and liquid solutions was observed for thicknesses of films close to a few (up to 10) monolayers. On the other hand, the absorption spectra maxima positions of one-component dye films (upper 10 nm) and composite films with high concentration, did not match the corresponding positions of absorption spectra maxima recorded in solutions. Comparison of the absorption spectra in one-component dye films and in solutions indicates the presence of both monomers and their aggregates in one-component films (contrary to solutions where such processes of aggregation do not take place, even at very high concentrations). Simultaneously with aggregation manifestation in the absorption spectra, the intensity of fluorescence of one-component dye films dramatically decreases. A quantum chemical simulation of the possible relative arrangement of two dye molecules indicates that the most possible of the simplest types of aggregates are physical dimers. Films of practical importance (due to efficient energy transfer from host to guest molecules when all singlet excitons are captured) possess a high quantum yield of fluorescence when reaching an impurity concentration of a few percent (aggregation does not take place yet).
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spelling doaj.art-87a1b5393a484911ac12e5c7005307052023-11-22T16:24:24ZengMDPI AGMaterials1996-19442021-09-011419561510.3390/ma14195615Aggregate Formation of Boron-Containing Molecules in Thermal Vacuum Deposited FilmsOleksandr Navozenko0Valeriy Yashchuk1Oleksiy Kachkovsky2Dalius Gudeika3Rita Butkute4Yuriy Slominskii5Volodymyr Azovskyi6Faculty of Physics, Taras Shevchenko National University of Kyiv, 64/13 Volodymyrs’ka Str., 01601 Kyiv, UkraineFaculty of Physics, Taras Shevchenko National University of Kyiv, 64/13 Volodymyrs’ka Str., 01601 Kyiv, UkraineV.P. Kukhar Institute of Bioorganic Chemistry and Petrochemistry, Murmanskaya Street, 1, 02660 Kyiv, UkraineDepartment of Polymer Chemistry and Technology, Kaunas University of Technology, Radvilenu pl. 19, LT-50254 Kaunas, LithuaniaDepartment of Polymer Chemistry and Technology, Kaunas University of Technology, Radvilenu pl. 19, LT-50254 Kaunas, LithuaniaInstitute of Organic Chemistry, National Academy of Sciences of Ukraine, 5 Murmanska Str., 02660 Kyiv, UkraineFaculty of Physics, Taras Shevchenko National University of Kyiv, 64/13 Volodymyrs’ka Str., 01601 Kyiv, UkraineThe spectral properties of new boron-containing dyes were studied. One-component (pure dyes) and composite “Alq<sub>3</sub>+dye” thin films were fabricated using the thermal vacuum deposition method. The positions of the transmission spectra maxima in a one-component film are different for different film thicknesses. The best correlation of the maxima positions of the dye transmission spectra in solid and liquid solutions was observed for thicknesses of films close to a few (up to 10) monolayers. On the other hand, the absorption spectra maxima positions of one-component dye films (upper 10 nm) and composite films with high concentration, did not match the corresponding positions of absorption spectra maxima recorded in solutions. Comparison of the absorption spectra in one-component dye films and in solutions indicates the presence of both monomers and their aggregates in one-component films (contrary to solutions where such processes of aggregation do not take place, even at very high concentrations). Simultaneously with aggregation manifestation in the absorption spectra, the intensity of fluorescence of one-component dye films dramatically decreases. A quantum chemical simulation of the possible relative arrangement of two dye molecules indicates that the most possible of the simplest types of aggregates are physical dimers. Films of practical importance (due to efficient energy transfer from host to guest molecules when all singlet excitons are captured) possess a high quantum yield of fluorescence when reaching an impurity concentration of a few percent (aggregation does not take place yet).https://www.mdpi.com/1996-1944/14/19/5615fluorescencedimersquantum chemical modelingthermal vacuum depositioncyanine dyesboron-containing molecules
spellingShingle Oleksandr Navozenko
Valeriy Yashchuk
Oleksiy Kachkovsky
Dalius Gudeika
Rita Butkute
Yuriy Slominskii
Volodymyr Azovskyi
Aggregate Formation of Boron-Containing Molecules in Thermal Vacuum Deposited Films
Materials
fluorescence
dimers
quantum chemical modeling
thermal vacuum deposition
cyanine dyes
boron-containing molecules
title Aggregate Formation of Boron-Containing Molecules in Thermal Vacuum Deposited Films
title_full Aggregate Formation of Boron-Containing Molecules in Thermal Vacuum Deposited Films
title_fullStr Aggregate Formation of Boron-Containing Molecules in Thermal Vacuum Deposited Films
title_full_unstemmed Aggregate Formation of Boron-Containing Molecules in Thermal Vacuum Deposited Films
title_short Aggregate Formation of Boron-Containing Molecules in Thermal Vacuum Deposited Films
title_sort aggregate formation of boron containing molecules in thermal vacuum deposited films
topic fluorescence
dimers
quantum chemical modeling
thermal vacuum deposition
cyanine dyes
boron-containing molecules
url https://www.mdpi.com/1996-1944/14/19/5615
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