Search Results - "Atohoun, Guy Y.S."
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Impact of organic dye-photosensitizer on TiO2 nanocrystalline surface for high performance organic electronic devices: A computational insight
Published in Journal of photochemistry and photobiology. A, Chemistry. (01-08-2023)“…[Display omitted] •Design and optoelectronic properties analysis of organic material OS, SS and OSS dyes series using DFT and TD-DFT methodology.•All the…”
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Biomass residues purification: elimination of oxygen from oxolane and its monomethylated derivatives through hydrodeoxygenation process
Published in Physica scripta (01-04-2024)“…Abstract The persistent global demand of fossil fuels has spurred significant interest in the invention of new renewable energy sources to replace finite,…”
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Quantum chemical hydrogenolysis strategy for elimination of heteroatoms in biomass homologous organic compounds based on oxolane and thiolane
Published in Journal of molecular graphics & modelling (01-11-2022)“…Bio-oils obtained from biomass contain heteroatoms compounds, like oxolane and thiolane. It is quite difficult for industrialist to purify such refractory…”
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Quantum mechanistic study of furan and 2-methylfuran hydrodeoxygenation on molybdenum and tungsten sulfide clusters
Published in Journal of molecular modeling (01-08-2019)“…One of the possibilities of limiting carbon dioxide emissions is to use pyrolysis oils from biomass. However, their very high oxygen content confers to these…”
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