1. Biorefining Twin Transition: Digitalisation for Bio-based Chemicals/Materials - Discovery, Design and Optimisation
- Author
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Matej Žula, Miha Grilc, Andrii Kostyniuk, Giorgio Tofani, Edita Jasiukaitytė-Grojzdek, Tina Ročnik Kozmelj, Ramesh Kumar Chowdari, Žan Lavrič, Janvit Teržan, Brigita Hočevar, Ana Jakob, Emilija Rakić, Brett Pomeroy, Miša Mojca Cajnko, Filipa A. Vicente, Dana Marinič, Ana Oberlintner, Uroš Novak, Davide Benedetto Tiz, Matej Huš, and Blaž Likozar
- Subjects
Bioeconomy ,Biorefinery ,Catalytic conversion ,Fractionation and downstream ,Chemistry ,QD1-999 - Abstract
The article discusses the production of platform chemicals from various biological sources, including glycerol, lignin, cellulose, bio-oils, and sea products. It presents the results of catalytic and downstream processes involved in the conversion of these biomass-derived feedstocks. The experimental approaches are complemented by numerical descriptions, ranging from density functional theory (DFT) calculations to kinetic modellingof the experimental data. This multi-scale modelling approach helps to understand the underlying mechanisms and optimize the production of platform chemicals from renewable resources.
- Published
- 2023
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