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Aug 15, 2019Article Details
How to Cite
Fernandes de Farias, R. (2019). Using molecular modelling to study bond dissociation energy: Methane as a study case. African Journal of Chemical Education, 9(2), 4–7. Retrieved from https://www.ajol.info/index.php/ajce/article/view/188871
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Main Article Content
Using molecular modelling to study bond dissociation energy: Methane as a study case
Abstract
The present work describes how molecular modelling (DFT approach) can be used to calculated the H3C-H bond dissociation energy, in a didactical approach that can be employed in both, undergraduate or graduation courses.
