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Published in 2025 at "Journal of Materials Chemistry A"
DOI: 10.1039/d5ta04855a
Abstract: Gibbs free energy engineering based on high-throughput density functional theory (DFT) calculations combined with machine learning for materials screening in low-temperature thermochemical CO2 splitting.
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Keywords:
temperature thermochemical;
energy engineering;
free energy;
low temperature ... See more keywords