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Investigating the Thermodynamics and Kinetics of Catechin Pyrolysis for Environmentally Friendly Binders

[Image: see text] The thermodynamics and kinetics of the pyrolysis of (+)-catechin, a building block of the condensed tannins found in recipes for sustainable binders, are evaluated at the DLPNO-CCSD(T) level and compared to other methods from quantum chemistry. Using the climbing image nudged elast...

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Detalles Bibliográficos
Autores principales: Kraus, Jakob, Kortus, Jens
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10099430/
https://www.ncbi.nlm.nih.gov/pubmed/37065063
http://dx.doi.org/10.1021/acsomega.2c07756