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Source: Journal of materials chemistry. 2022. Vol. 10, № 12. P. 4894-4904
Type: статьи в журналах
Date: 2022
Description:
New perhalophenyl three-coordinated gold(i) complexes using the chelate ligand 1,2-bis(diphenyl-phosphino)benzene (dppBz) and [AuR(tht)] (R = C6F5 (1), o-C6BrF4 (2), p-C6BrF4 (3), o-C6F4I (4), p-C6F4I
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Source: Physical chemistry chemical physics. 2022. Vol. 24, № 2. P. 624-628
Type: статьи в журналах
Date: 2022
Source: Physical chemistry chemical physics. 2022. Vol. 24, № 3. P. 1666-1674
Type: статьи в журналах
Date: 2022
Source: The Journal of Physical Chemistry A. 2022. Vol. 126, № 16. P. 2445-2452
Type: статьи в журналах
Date: 2022
Description:
Cyclo[n]carbons (n = 5, 7, 9,..., 29) composed from an odd number of carbon atoms are studied computationally at density functional theory (DFT) and ab initio complete active space self-consistent fie
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Source: Russian physics journal. 2022. Vol. 64, № 11. P. 2082-2088
Type: статьи в журналах
Date: 2022
Description:
Using the method of the density functional theory (DFT/B3LYP/6-31G(d,p)), the vibrational absorption and emission spectra of bifluorene and terfluorene molecules are calculated. A good agreement is ob
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Source: Chemical engineering journal. 2021. Vol. 426. P. 131282 (1-8)
Type: статьи в журналах
Date: 2021
Description:
Triplet fusion upconversion is useful for a broad spectrum of applications ranging from solar cells, photoredox catalysis, to biophotonics applications, especially in the near-infrared (NIR,>700 nm) r
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Authors:
Pedersen, Stephan K. |
Pedersen, Viktor B. R. |
Kamounah, Fadhil S. |
Broløs, Line M. |
Baryshnikov, Gleb V. |
Valiev, Rashid R. |
Ivaniuk, Khrystyna |
Stakhira, Pavlo |
Minaev, Boris F. |
Karaush-Karmazin, Nataliya N. |
Ågren, Hans |
Pittelkow, Michael
Source: Chemistry - a European journal. 2021. Vol. 27, № 45. P. 11609-11617
Type: статьи в журналах
Date: 2021
Description:
A soluble and green-blue fluorescent -extended azatrioxa[8]circulene was synthesized by oxidative condensation of a 3,6-dihydroxycarbazole and 1,4-anthraquinone utilizing benzofuran scaffolding. This
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Source: Physical chemistry chemical physics. 2021. Vol. 23, № 11. P. 6344-6348
Type: статьи в журналах
Date: 2021
Description:
An efficient method for estimating non-adiabatic coupling matrix elements (NACME) and rate constants for internal conversion (kIC) is presented. The method, based on Plotnikov’s theory, requires only
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Source: Journal of Quantitative Spectroscopy and Radiative Transfer. 2021. Vol. 273. P. 107834 (1-12)
Type: статьи в журналах
Date: 2021
Description:
The Franck-Condon factors were calculated for vertical electronic transitions between the ground singlet (X1 A1 ) and 3 A2 , 3 B2 , and 3 B1 excited triplet states associated with the Wulf band of the
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Authors:
Knysh, Iryna |
Kozakiewicz-Piekarz, Anna |
Wojtczak, Andrzej |
Plażuk, Damian |
Baryshnikov, Gleb V. |
Valiev, Rashid R. |
Nasibullin, Rinat T. |
Ågren, Hans |
Jacquemin, Denis |
Ośmiałowski, Borys |
Zaleśny, Robert
Source: Journal of materials chemistry C. 2021. Vol. 9, № 44. P. 15820-15830
Type: статьи в журналах
Date: 2021
Description:
We investigate the emission properties of four organic dyes containing a strong electron-donating N(CH3)2 group and an NBF2O-bearing heterocyclic moiety acting as the electron-accepting group. The fou
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Source: Chemical сommunications. 2019. Vol. 55, № 54. P. 7760-7763
Type: статьи в журналах
Date: 2019
Description:
A ditriflate derivative of 2-iodoxybenzoic acid (IBX) was prepared by the reaction of IBX with trifluoromethanesulfonic acid and characterized by single crystal X-ray crystallography. IBX-ditriflate i
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Source: Physical chemistry chemical physics. 2019. Vol. 21, № 18. P. 9246-9254
Type: статьи в журналах
Date: 2019
Description:
The electronic structure, absorption and emission spectra, aromaticity and photophysical behavior of the recently synthesized tetrasilatetrathia[8]circulene and tetragermatetrathia[8]circulene compoun
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Source: Chemical physics letters. 2019. Vol. 723. P. 123-127
Type: статьи в журналах
Date: 2019
Description:
Acetyl protecting groups are commonly used in carbohydrate chemistry. Partially acetylated arylglycosides are not only useful building blocks in syntheses, but they are also substantial for plant meta
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Source: Russian physics journal. 2019. Vol. 62, № 1. P. 140-146
Type: статьи в журналах
Date: 2019
Description:
Results of theoretical and experimental studies of exciplex of a zinc complex Zn(DFP-SAMQ)2 with the hole-transporting layer of NPD are presented. It is shown that at least three different arrangement
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Source: New journal of chemistry. 2019. Vol. 43, № 30. P. 12178-12190
Type: статьи в журналах
Date: 2019
Description:
A series of thia[7]circulenes and novel Se-, Te-, S/Te-, and Se/Te-substituted [8]circulenes have been studied by calculations of nucleus-independent chemical shift indices and gauge including magneti
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