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34 results for “Photocatalyst”

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zenodo32/100

Quantitative prediction of excited-state decay rates for radical anion photocatalysts

<p>The input and output files related to the DFT calculations carried out for the work entitled &quot;Quantitative prediction of excited-state decay rates for radical anion photocatalysts&quot; are loaded in this repository.</p> <p>The zip file contains the optimized geometries of the compounds involved in the job.</p> <pre>&nbsp;</pre>

opencc-by-4.0May 2023View details →
zenodo32/100

Photophysical and Spectroscopic dataset for Ag–In–Zn–S Quaternary Nanocrystals Prepared from InCl2 Precursor as Visible Light Photocatalysts of Aromatic Aldehyde Photoreduction

<p>(1) Energy-dispersive spectra of alloyed Ag-In-Zn-S nanocrystals before (Ag<sub>1.0</sub>In<sub>1.5</sub>Zn<sub>0.3</sub>S<sub>3.3</sub>(S<sub>3.0</sub>) (R)&nbsp; and&nbsp; Ag<sub>1.0</sub>In<sub>10.3</sub>Zn<sub>12.4</sub>S<sub>11.8</sub>(S<sub>28.3</sub>) (G)) and after the exchange of initial capping ligands for 11-mercaptoundecanoic acid (Ag<sub>1.0</sub>In<sub>1.3</sub>Zn<sub>0.5</sub>S<sub>3.3</sub>(S<sub>3.0</sub>) (R-MUA) and (Ag<sub>1.0</sub>In<sub>2.7</sub>Zn<sub>30.0</sub>S<sub>90.0</sub>(S<sub>34.5</sub>) (G-MUA)).</p> <p>(2) HR-TEM images of Ag<sub>1.0</sub>In<sub>1.5</sub>Zn<sub>0.3</sub>S<sub>3.3</sub>(S<sub>3.0</sub>) (R)&nbsp; and&nbsp; Ag<sub>1.0</sub>In<sub>10.3</sub>Zn<sub>12.4</sub>S<sub>11.8</sub>(S<sub>28.3</sub>) (G) alloyed nanocrystals.</p> <p>(3) UV-vis-NIR spectra of toluene dispersion of Ag<sub>1.0</sub>In<sub>1.5</sub>Zn<sub>0.3</sub>S<sub>3.3</sub>(S<sub>3.0</sub>) (R),&nbsp; Ag<sub>1.0</sub>In<sub>10.3</sub>Zn<sub>12.4</sub>S<sub>11.8</sub>(S<sub>28.3</sub>) (G) and water dispersion of Ag<sub>1.0</sub>In<sub>1.3</sub>Zn<sub>0.5</sub>S<sub>3.3</sub>(S<sub>3.0</sub>) (R-MUA), Ag<sub>1.0</sub>In<sub>2.7</sub>Zn<sub>30.0</sub>S<sub>90.0</sub>(S<sub>34.5</sub>) (G-MUA) nanocrystals.</p> <p>(4) Photoluminescence excitation and emission spectra of toluene dispersion of Ag<sub>1.0</sub>In<sub>1.5</sub>Zn<sub>0.3</sub>S<sub>3.3</sub>(S<sub>3.0</sub>) (R),&nbsp; Ag<sub>1.0</sub>In<sub>10.3</sub>Zn<sub>12.4</sub>S<sub>11.8</sub>(S<sub>28.3</sub>) (G) nanocrystals and the corresponding spectra of water dispersion of Ag<sub>1.0</sub>In<sub>1.3</sub>Zn<sub>0.5</sub>S<sub>3.3</sub>(S<sub>3.0</sub>) (R-MUA), Ag<sub>1.0</sub>In<sub>2.7</sub>Zn<sub>30.0</sub>S<sub>90.0</sub>(S<sub>34.5</sub>) (G-MUA) nanocrystals.</p> <p>(5) Photoluminescence decay curves of toluene dispersion of Ag<sub>1.0</sub>In<sub>1.5</sub>Zn<sub>0.3</sub>S<sub>3.3</sub>(S<sub>3.0</sub>) (R),&nbsp; Ag<sub>1.0</sub>In<sub>10.3</sub>Zn<sub>12.4</sub>S<sub>11.8</sub>(S<sub>28.3</sub>) (G) and water dispersion of Ag<sub>1.0</sub>In<sub>1.3</sub>Zn<sub>0.5</sub>S<sub>3.3</sub>(S<sub>3.0</sub>) (R-MUA), Ag<sub>1.0</sub>In<sub>2.7</sub>Zn<sub>30.0</sub>S<sub>90.0</sub>(S<sub>34.5</sub>) (G-MUA) nanocrystals.</p> <p>(6) XPS survey and high-resolution spectra of alloyed Ag-In-Zn-S nanocrystals before Ag<sub>1.0</sub>In<sub>1.5</sub>Zn<sub>0.3</sub>S<sub>3.3</sub>(S<sub>3.0</sub>) (R) and &nbsp;Ag<sub>1.0</sub>In<sub>10.3</sub>Zn<sub>12.4</sub>S<sub>11.8</sub>(S<sub>28.3</sub>) (G) &nbsp;and after the exchange of initial capping ligands for 11-mercaptoundecanoic acid (Ag<sub>1.0</sub>In<sub>1.3</sub>Zn<sub>0.5</sub>S<sub>3.3</sub>(S<sub>3.0</sub>) (R-MUA) and Ag<sub>1.0</sub>In<sub>2.7</sub>Zn<sub>30.0</sub>S<sub>90.0</sub>(S<sub>34.5</sub>) (G-MUA)).</p> <p>(7) <sup>1</sup>H, <sup>1</sup>H-<sup>1</sup>H COSY and <sup>13</sup>C, <sup>1</sup>H-<sup>13</sup>C HMQC NMR spectra of the photocatalytic reduction reaction mixture used for the photocatalytic reduction of 4-chlorobenzaldehyde and furfural.</p> <p>(8) GC chromatogram of the photocatalytic reduction reaction mixture used for photocatalytic reduction of 4-chlorobenzaldehyde.</p> <p>(9) DMPO spin-trapping EPR spectra of &nbsp;toluene dispersion of Ag<sub>1.0</sub>In<sub>1.5</sub>Zn<sub>0.3</sub>S<sub>3.3</sub>(S<sub>3.0</sub>) (R),&nbsp; Ag<sub>1.0</sub>In<sub>10.3</sub>Zn<sub>12.4</sub>S<sub>11.8</sub>(S<sub>28.3</sub>) (G) nanocrystals and reaction mixture used for the photocatalytic reduction of furfural.</p> <p>&nbsp;</p> <p>This work was supported by the National Science Centre of Poland, Grant No. 2022/45/B/ST5/02120.</p>

opencc-by-4.0Aug 2023View details →
dryad32/100

Preparation and performance of Al3+-doped BiVO4 semiconductor photocatalysts

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publicNov 2020View details →
dryad32/100

Data from: Facile fabrication of Mn2+ doped ZnO photocatalysts by electrospinning

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publicJan 2020View details →
dryad32/100

Decolorization of crystal violet using nano-sized novel fluorite structure Ga2Zr2-xWxO7 photocatalyst under visible light irradiation

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publicFeb 2020View details →
dryad28/100

Data from: Akaganeite nanorices deposited muscovite mica surfaces as sunlight active green photocatalyst

Thin-films of akaganeite [FeO(OH)] nanorices deposited muscovite mica (ANPM) surfaces are produced using the facile urea assisted controlled self-assembly technique. The synthesized materials are characterized using scanning electron microscopy (SEM) with energy dispersive X-ray spectroscopy (EDS), atomic force microscopy, X-ray diffraction (XRD), Fourier transform infrared (FT-IR) spectroscopy and thermo gravimetric analysis (TGA). The prepared nanorices on mica surfaces show average particle length and width as 200 nm and 50 nm respectively. Synthesized material acts as an efficient photocatalyst under UV and sunlight conditions as demonstrated by the degradation of standard methylene blue solution. The methylene blue degradation efficiencies of the catalyst under exposure to 180 min sunlight and UV are 89% and 87.5% respectively which shows that the catalyst is highly active under sunlight than under UV light. Therefore, the synthesized material is a potential green photocatalyst in efficient treatment of industrial dye effluents under direct sunlight.

opencc-zeroDec 2018View details →
zenodo28/100

Two-dimensional arsenene/HfNBr van der Waals Heterojunction as water splitting photocatalyst: first-principles predictions

<p>Please see ref:</p> <p>&nbsp;</p> <p>(under review)</p>

opencc-by-nc-4.0Mar 2024View details →
zenodo28/100

Enhancement of carbamazepine photodegradation using hybrid of phosphorescent carbon dots coupled with highly porous TiO2 photocatalyst

<p>Data used for creation of the Figures for publication</p>

opencc-by-4.0Sep 2024View details →
dryad28/100

Facile approach to defect-rich ZnO photocatalysts for visible light dye degradation

<p>We established an effective synthesis approach to prepare planar-defect-rich-zinc oxide (ZnO) nanoparticles via a facile coprecipitation technique. The effect of acetate, sulfate, and nitrate salt precursors along with synthesis temperature on the physiochemical behavior of ZnO nanoparticles was explored. Various analytical techniques were utilized to illustrate the present phases, intrinsic structure, extrinsic morphology, and optical properties of the final products. Pure hexagonal wurtzite phase for the ZnO nanoparticles with spherical morphology ranging from 30 nm to 70 nm in size displayed superior photocatalytic activity owing to the presence of a high density of dislocation and stacking faults. A visible-light photocatalytic degradation study of methylene blue and rhodamine B dye was carried out. Prepared ZnO nanoparticles were able to degrade over 93% of 22 MB dye and 98.85% RhB dye in an hour. This excellent visible-light photocatalytic activity is credited to the porous nature of the nanoparticles offering increased surface area and the presence of planar defects which effectively repress electron-hole recombination by taking care of charge carrier trapping and transferring.</p>

opencc-zeroMay 2023View details →
dryad28/100

Facile approach to defect-rich ZnO photocatalysts for visible light dye degradation

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publicMay 2023View details →
dryad28/100

Data from: Akaganeite nanorices deposited muscovite mica surfaces as sunlight active green photocatalyst

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publicMar 2019View details →
zenodo24/100

Steam methane reforming using a regenerable antenna-reactor plasmonic photocatalyst

<p>This dataset contains zip files for the following categories:&nbsp;</p> <p>1) Data for reproducing the plots in 'Steam methane reforming using a regenerable antenna-reactor plasmonic photocatalyst.'&nbsp;</p> <p>2) Details of electrodynamic simulation and DFT calculations of the carrier distribution, including the input files (atomic coordinates for the jDFTx), codes, log files, output files, and tutorials.&nbsp;</p> <p>3) Raw gas chromatography (GC) data, including the method file for the GC.&nbsp;</p> <p>&nbsp;</p>

opencc-by-4.0Aug 2024View details →
zenodo24/100

DFT and TDDFT-predicted equilibrium structures of bipyridine-annulated perylene tetracarboxylic ester photocatalysts with PdCl2 and PtCl2

<p>Fully relaxed equilibrium structures of <strong>P-Pd</strong> and <strong>P-Pt</strong> as predicted at the DFT and TDDFT levels of theory (B3LYP/def2-SVP) including D3BJ dispersion correction and implicit solvent effects (CH<sub>2</sub>Cl<sub>2</sub>). Both photocatalysts were optimized in singlet (S0) and triplet multiplicity in order to evaluate the Franck-Condon photophysics as well as the prominent triplet species involved in the photphysical and photochemical properties, i.e. triplet intra-ligand (3IL) and triplet metal-to-ligand charge transfer (MLCT) states. The multiplicity is indicated in the filename.</p>

openFeb 2023View details →
zenodo12/100

Original SEM images for the Manuscript: Postindustrial jute waste as a support for nano-carbon nitride photocatalyst: Influence of the chemical pretreatment

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restrictedcc-by-4.0Jun 2024View details →

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