| Literature DB >> 35698245 |
Dirk Ziegenbalg1, Andrea Pannwitz2, Sven Rau2, Benjamin Dietzek-Ivanšić3,4, Carsten Streb2,5.
Abstract
Light-driven homogeneous and heterogeneous catalysis require a complex interplay between light absorption, charge separation, charge transfer, and catalytic turnover. Optical and irradiation parameters as well as reaction engineering aspects play major roles in controlling catalytic performance. This multitude of factors makes it difficult to objectively compare light-driven catalysts and provide an unbiased performance assessment. This Scientific Perspective highlights the importance of collecting and reporting experimental data in homogeneous and heterogeneous light-driven catalysis. A critical analysis of the benefits and limitations of the commonly used experimental indicators is provided. Data collection and reporting according to FAIR principles is discussed in the context of future automated data analysis. The authors propose a minimum dataset as a basis for unified collecting and reporting of experimental data in homogeneous and heterogeneous light-driven catalysis. The community is encouraged to support the future development of this parameter list through an open online repository.Entities:
Keywords: Comparability; Heterogeneous; Homogeneous; Light-Driven Catalysis; Photocatalysis
Year: 2022 PMID: 35698245 PMCID: PMC9401044 DOI: 10.1002/anie.202114106
Source DB: PubMed Journal: Angew Chem Int Ed Engl ISSN: 1433-7851 Impact factor: 16.823
Figure 1Typical experimental setup, principal steps, and reactive component types employed in light‐driven catalysis.
Figure 2Typical experimental parameters in light‐driven catalysis and the frequency of their study in light‐driven catalysis.
Figure 3Illustration of the key parameters affecting light‐driven catalysis and the challenge of determining unbiased performance indicators.
Figure 4Example graphs illustrating the relationship between Δn(product), TON, TOF, and reaction rate r.
Figure 5Photon‐based performance indicators and their relation to the photochemical experimental setup; light‐absorbing species (A), photonic efficiency (PE), photonic yield (PY), quantum efficiency (QE), quantum yield (QY).[ , ]
First version of the suggested dataset to enable objective comparison of light‐driven catalytic experiments.
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Type of Parameters |
Parameter |
Comments |
|---|---|---|
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purity |
for all chemical species used |
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concentrations and molar amounts |
for all chemical species used |
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pH value/proton concentration |
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absorption coefficients as function of wavelength |
of all light‐absorbing species |
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materials |
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geometry |
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dimensions |
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positioning |
reactor, light source, filter |
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reaction volume |
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temperature |
ideally time resolved |
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atmosphere and pressure |
pressure ideally time resolved |
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operation mode |
continuous, batch, semi‐continuous |
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stirring speed |
if applicable |
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flow rates |
if applicable |
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reaction time |
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emission spectrum |
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photon flux |
ideally within the reactor, alternatively, at the outside reactor wall |
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ideally time resolved |
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molecular systems; ideally time resolved |
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molecular systems; time resolved |
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reaction rate |
heterogeneous systems; time resolved |
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for systems driven by solar irradiation |