Ara
Toplam kayıt 5, listelenen: 1-5
Possible reaction pathways of the lincomycin molecule according to the DFT calculation method
(Serbian Chemical Soc, 2017)
Human-used antibiotics are eliminated from the body with little or no transformation at all. Traces of eliminated antibiotics enter the receiving environment directly since they cannot be treated in prevalent wastewater ...
Influence of Se/N Codoping on the Structural, Optical, Electronic and Photocatalytic Properties of TiO2
(Mdpi Ag, 2017)
Se4+ and N3- ions were used as codopants to enhance the photocatalytic activity of TiO2 under sunlight irradiation. The Se/N codoped photocatalysts were prepared through a simple wet-impregnation method followed by heat ...
Molecules of benidipine: experimental and theoretical investigation
(Bulgarian Acad Science, 2017)
In the search for a plausible mechanism for the photocatalytic degradation reaction of BEN, DFT reactivity descriptors were employed to have information about the most susceptible sites for hydroxyl radical attack. ...
Photocatalytic degradation of cefazolin over N-doped TiO 2 under UV and sunlight irradiation: Prediction of the reaction paths via conceptual DFT
(2012)
Cefazolin is a semi-synthetic antibiotic found in aqueous environments as a pollutant due to its widespread use. The photocatalytic degradation of cefazolin was investigated in aqueous N-doped and undoped-TiO 2 suspensions ...
Enhanced solar photocatalytic activity of TiO2 by selenium(IV) ion-doping: Characterization and DFT modeling of the surface
(2013)
TiO2 was doped with Se(IV) ions to obtain a visible light active photocatalyst with high photocatalytic activity. In order to characterize and describe the effect of Se(IV)-doping on the electronic and structural properties ...