Cargando…
Ab Initio Kinetics of Initial Thermal Pyrolysis of Isopropyl Propionate: A Revisited Study
[Image: see text] This work reports a detailed mechanism of the initial thermal pyrolysis of isopropyl propionate, (C(2)H(5)C(=O)OCH(CH(3))(2)), an important biodiesel additive/surrogate, for a wide range of T = 500–2000 K and P = 7.6–76 000 Torr. The detailed kinetic behaviors of the title reaction...
Autores principales: | Mai, Tam V.-T., Huynh, Lam K. |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2021
|
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8756594/ https://www.ncbi.nlm.nih.gov/pubmed/35036732 http://dx.doi.org/10.1021/acsomega.1c05280 |
Ejemplares similares
-
Hydration of trivalent lanthanum revisited – An ab initio QMCF-MD approach
por: Lutz, Oliver M.D., et al.
Publicado: (2012) -
QCD thermalization: Ab initio approaches and interdisciplinary connections
por: Berges, Jürgen, et al.
Publicado: (2020) -
Computational studies on thermo-kinetics aspects of pyrolysis of isopropyl acetate and its methyl, bromide and hydroxyl derivatives
por: Shojaei, S.H. Reza, et al.
Publicado: (2022) -
Thermal decomposition behavior and kinetics for pyrolysis and catalytic pyrolysis of Douglas fir
por: Wang, Lu, et al.
Publicado: (2018) -
Ab Initio Thermochemistry of Highly
Flexible Molecules for Thermal Decomposition Analysis
por: Kwon, Hyunguk, et al.
Publicado: (2023)