Электронная библиотека (репозиторий) Томского государственного университета
Ågren, Hans

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Add   Aromaticity and photophysics of tetrasila- and tetragerma-annelated tetrathienylenes as new representatives of the hetero[8]circulene family
Authors: Valiev, Rashid R. | Cherepanov, Victor N. | Karaush-Karmazin, Nataliya N. | Minaeva, Valentina A. | Minaev, Boris F. | Ågren, Hans | Baryshnikov, Gleb V.
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 ... More
Add   Impact of heteroatoms (S, Se, and Te) on the aromaticity of heterocirculenes
Authors: Baryshnikov, Gleb V. | Valiulina, Lenara I. | Valiev, Rashid R. | Ågren, Hans | Minaev, Boris F. | Karaush-Karmazin, Nataliya N.
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 ... More
Add   A computational study of aromaticity and photophysical properties of unsymmetrical azatrioxa[8]circulenes
Authors: Valiev, Rashid R. | Minaev, Boris F. | Ågren, Hans | Baryshnikov, Gleb V.
Source: New journal of chemistry. 2017. Vol. 41, № 7. P. 2717-2723
Type: статьи в журналах
Date: 2017
Description: Owing to their potential use in organic light-emitting diodes and field-effect transistors we present a theoretical study of a series of unsymmetrical azatrioxa[8]circulenes in order to explain the im ... More
Add   Recent progress in quantum chemistry of hetero[8]circulenes
Authors: Baryshnikov, Gleb V. | Minaeva, Valentina A. | Ågren, Hans | Minaev, Boris F. | Karaush, Nataliya N.
Source: Molecular physics. 2017. Vol. 115, № 17/18. P. 2218-2230
Type: статьи в журналах
Date: 2017
Description: This mini-review presents recent advances in theory of electronic and spectral properties of hetero[8]circulenes used as promising fluorescent emitters for organic light-emitting diodes. Special atten ... More
Add   Structural and electronic properties of poly(9,9-dialkylfluorene)-based alternating copolymers in solution: An NMR spectroscopy and density functional theory study
Authors: Ramos, M. Luísa | Abreu, P. E. | Charas, Ana | Morgado, Jorge | Scherf, Ullrich | Minaev, Boris F. | Ågren, Hans | Burrows, Hugh D. | Justino, Licínia L. G.
Source: The Journal of Physical Chemistry C. 2013. Vol. 117, № 35. P. 17969-17982
Type: статьи в журналах
Date: 2013
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