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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 Politechnika Łódzka, 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 ...
Effect of molecule dipolemoment on hole conductivity of polycrystalline anthrone and anthrachinone layers.
(Wydawnictwo Politechnika Łódzka, 2015)
Complex analyzes were made using methods of molecular quantum mechanics to investigate the effect of the dipole moment of the molecule carrier drift mobility in polycrystalline layers composed of anthrone and anthrachinone ...
The effect of the dipole moment on hole conductivity of polycrystalline films of two anthracene derivatives
(Wydawnictwo Politechnika ŁódzkaLodz University of Technology, 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 ...