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The effect of symmetry of a molecule electronic density on the dipole moment of unit cell and hole conductivity of thin polycrystalline films of anthrone and anthraquinone.
(Wydawnictwo Politechniki ŁódzkiejLodz University of Technology. Press, 2016)
The electronic structure of anthrone and anthraquinone
molecules in the gas state and in the simulated crystal unit cell were calculated with time dependent-density functional theory (TD-DFT) method. The values of dipole ...
The effect of the dipole moment on hole conductivity of polycrystalline films of two anthracene derivatives
(Wydawnictwo Politechniki ŁódzkiejLodz University of Technology. Press, 2017)
Hole mobility in the polycrystalline layers of anthrone and
anthraquinone differs in one order of magnitude in spite of nearly the
same crystalline structure. The origin of this difference was determined
with use of the ...
The origin of the interaction responsible for the difference of hole mobility of thwo derivatives of anthracene
(Wydawnictwo Politechniki ŁódzkiejLodz University of Technology. Press, 2018)
Hole mobility of the layers built from two anthracene
derivatives differing in the substitution of the central benzene ring,
i.e. anthrone substituted with only one keto group and anthraquinone
substituted with two keto ...
Electrical and thermal properties of anthraquinone layers
(Lodz University of Technology PressWydawnictwo Politechniki Łódzkiej, 2019)
Quantum-chemical calculations indicate that the bond lengths in the anthraquinone anthracene backbone are shorter than the corresponding bonds in unsubstituted anthracene. The shape of the frontier molecular ...
Polarization of organic aromatic molecule in anionic and cationic state
(Lodz University of Technology PressWydawnictwo Politechniki Łódzkiej, 2019)
The modification of electron states and the change in the geometry of the structure of molecule during hopping transport of charge carriers depends on the symmetry of the molecule. During electric transport the ...