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Published in 2023 at "Journal of the American Chemical Society"
DOI: 10.1021/jacs.3c01980
Abstract: Enzymatic systems achieve the catalytic conversion of methane at room temperature under mild conditions. In this study, varying thermodynamic and kinetic parameters, we show that the reforming of methane by water (MWR, CH4 + H2O…
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Keywords:
methane;
room temperature;
conversion methane;
zro2 111 ... See more keywords
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1
Published in 2018 at "Faraday discussions"
DOI: 10.1039/c7fd00217c
Abstract: The performance of supported metal catalysts, such as nickel nanoparticles decorating yttria-stabilized zirconia (YSZ), depends on their microstructure and the metal-support interface. Here, we have used spin polarized density functional theory (DFT) to evaluate different…
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Keywords:
density functional;
zro2 111;
111 ysz;
ysz 111 ... See more keywords