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The change of electronic properties caused by the variation of bond angles will be discussed below.
NBO analysis performed over the system predicted small change of electronic configuration of central Ca atom.
Shift of wavelength absorption indicated to change of electronic transition in C-Dots.
Shift of wavelength absorbance indicates the change of electronic transition of C-Dots.
The change of electronic structure clearly confirmed that there was gap structure formation in C-Dots.
The excellent performance of NH3-treated WO3 CE can be ascribed to the change of electronic structure from tungsten oxide to tungsten oxynitride by NH3 treatment.
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With increasing the amount of Se dopant, the band gap decreases because of changes of electronic structure and trapping state evolves into a series of energy level.
Furthermore, the phase transition from cubic to wurtzite with increasing Al content in the alloys is correlated with changes of electronic structure and bonding in the systems.
In nanostructures composed of canonical thermoelectric materials, an increase of the ZT parameter is also expected, because the qualitative changes of electronic density of states (DOS) in quantum wells, wires, and dots should increase the Seebeck coefficient.
A continuous spinning of uniform PVA nanofibers proceeded by the addition of acetic acid due to the changes of electronic conductivity and surface tension of aqueous solution of PVA.
We explain these phenomena by the electric-field-induced changes of electronic density of localized states (DOLS), and we perform the calculations for DOLS by using the first-principles density functional theory.
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