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Multiscale modelling of CO2 hydrogenation of TiO2-supported Ni8 clusters: on the influence of anatase and rutile polymorphs

Chen, L.; Ye, Y.-Y.; Krösschell, R.D.E.; Hensen, E.J.M.; Filot, I.A.W.

Journal article 2024 Open access Corresponding author
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Abstract

The selection of TiO 2 phase, whether anatase or rutile, for supporting small Ni clusters significantly influences the activity and selectivity in CO 2 hydrogenation to methane.

Abstract from OpenAlex , checked 2026-06-30.

Citation

Chen, L.; Ye, Y.-Y.; Krösschell, R.D.E.; Hensen, E.J.M.; Filot, I.A.W. Multiscale modelling of CO2 hydrogenation of TiO2-supported Ni8 clusters: on the influence of anatase and rutile polymorphs. Catal. Sci. & Technol. 2024, 14, 6393-6410. 10.1039/d4cy00586d

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