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Reaction Mechanism of Aldehyde Groups during Coal Self-Heating
[Image: see text] In order to further understand the mechanism of coal self-heating in the initial stage, the aldehyde group was analyzed by using the quantum chemistry methods. The charge distribution, structural parameters, and molecular orbital were analyzed to determine the active sites existing...
| Autores principales: | , , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2020
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7495724/ https://www.ncbi.nlm.nih.gov/pubmed/32954169 http://dx.doi.org/10.1021/acsomega.0c02952 |