Name: supporting information for: Influence of Solvent on Selective Catalytic Reduction of Nitrogen Oxides with Ammonia over Cu-CHA Zeolite Date: 2022-12-22 00:00:00 UTC
Description: Supplementary data to article
DOI:
Location: https://pubs.acs.org/doi/suppl/10.1021/jacs.2c09823/suppl_file/ja2c09823_si_001.pdf
Article: Influence of Solvent on Selective Catalytic Reduction of Nitrogen Oxides with Ammonia over Cu-CHA Zeolite
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Name: supplementary video 1 Date: 2022-10-19 00:00:00 UTC
Description: Video of the breaking procedure for the PSCs. See also Supplementary Figure 11
DOI:
Location: https://static-content.springer.com/esm/art%3A10.1038%2Fs43246-022-00299-3/MediaObjects/43246_2022_299_MOESM4_ESM.mov
Article: Spherical hydroxyapatite nanoparticle scaffolds for reduced lead release from damaged perovskite solar cells
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Name: supplementary data for: Spherical hydroxyapatite nanoparticle scaffolds for reduced lead release from damaged perovskite solar cells Date: 2022-10-19 00:00:00 UTC
Description: Supplementary data to article
DOI:
Location: https://static-content.springer.com/esm/art%3A10.1038%2Fs43246-022-00299-3/MediaObjects/43246_2022_299_MOESM3_ESM.pdf
Article: Spherical hydroxyapatite nanoparticle scaffolds for reduced lead release from damaged perovskite solar cells
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Name: catalysts-11-00138-s001.pdf Date: 2021-01-18 00:00:00 UTC
Description: Related Article: Razali, Nurul, McGregor, James(2021) Improving Product Yield in the Direct Carb...
DOI:
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Name: XPS and STM studies of the oxidation of hydrogen chloride at Cu(100) surfaces Date: 2019-01-01 00:00:00 UTC
Description: XPS and STM studies of the oxidation of hydrogen chloride at Cu(100) surfaces. Data is organised...
DOI: 10.17035/d.2015.100122
Location: https://research.cardiff.ac.uk/converis/portal/detail/Dataset/1572980
Article: XPS and STM studies of the oxidation of hydrogen chloride at Cu(100) surfaces
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Name: Tuning of catalytic sites in Pt/TiO2 catalysts for chemoselective hydrogenation of 3-nitrostyrene Date: 2019-09-16 00:00:00 UTC
Description: The dataset contains the raw data of XPS, STEM, XAS, GC and CO DRIFT analysis of the Pt/TiO2 cat...
DOI: 10.17035/d.2019.0079744472
Location: https://research.cardiff.ac.uk/converis/portal/detail/Dataset/79744472?auxfun=&lang=en_GB
Article: Tuning of catalytic sites in Pt/TiO2 catalysts for the chemoselective hydrogenation of 3-nitrostyrene
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Name: Table S6: Absolute errors, mean absolute errors and standard deviations of reaction energies (in kcal mol−1) of reaction 1–20. The absolute errors are given relative to the CCSD(T)/aug-cc-pVTZ results Date: 2020-05-20 00:00:00 UTC
Description: Related Article: Sirirak, Jitnapa, Lawan, Narin, Van der Kamp, Marc W., Harvey, Jeremy N., Mulho...
DOI: 10.7717/peerj-pchem.8/supp-7
Location: http://dx.doi.org/10.7717/peerj-pchem.8/supp-7
Article: Benchmarking quantum mechanical methods for calculating reaction energies of reactions catalyzed by enzymes
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Name: Table S5: Mean signed errors, standard deviations, maximum errors and minimum errors along with their reaction number (Rxn No.) of reaction energies (in kcal mol<sup>−1</sup>) of reaction 1–20 Date: 2020-05-20 00:00:00 UTC
Description: Related Article: Sirirak, Jitnapa, Lawan, Narin, Van der Kamp, Marc W., Harvey, Jeremy N., Mulho...
DOI: 10.7717/peerj-pchem.8/supp-6
Location: http://dx.doi.org/10.7717/peerj-pchem.8/supp-6
Article: Benchmarking quantum mechanical methods for calculating reaction energies of reactions catalyzed by enzymes
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Name: Table S4: Errors of reaction energies (in kcal mol−1) of reaction 1–20, relative to the CCSD(T)/aug-cc-pVTZ results Date: 2020-05-20 00:00:00 UTC
Description: Related Article: Sirirak, Jitnapa, Lawan, Narin, Van der Kamp, Marc W., Harvey, Jeremy N., Mulho...
DOI: 10.7717/peerj-pchem.8/supp-5
Location: http://dx.doi.org/10.7717/peerj-pchem.8/supp-5
Article: Benchmarking quantum mechanical methods for calculating reaction energies of reactions catalyzed by enzymes
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Name: Table S3: Reaction energies (in kcal mol−1) of reaction 1–20 calculated by 24 quantum mechanics methods Date: 2020-05-20 00:00:00 UTC
Description: Related Article: Sirirak, Jitnapa, Lawan, Narin, Van der Kamp, Marc W., Harvey, Jeremy N., Mulho...
DOI: 10.7717/peerj-pchem.8/supp-4
Location: http://dx.doi.org/10.7717/peerj-pchem.8/supp-4
Article: Benchmarking quantum mechanical methods for calculating reaction energies of reactions catalyzed by enzymes
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