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Is the simplest chemical reaction really so simple?


ABSTRACT: Modern computational methods have become so powerful for predicting the outcome for the H + H2 ? H2 + H bimolecular exchange reaction that it might seem further experiments are not needed. Nevertheless, experiments have led the way to cause theorists to look more deeply into this simplest of all chemical reactions. The findings are less simple.

SUBMITTER: Jankunas J 

PROVIDER: S-EPMC3890794 | biostudies-literature | 2014 Jan

REPOSITORIES: biostudies-literature

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Is the simplest chemical reaction really so simple?

Jankunas Justin J   Sneha Mahima M   Zare Richard N RN   Bouakline Foudhil F   Althorpe Stuart C SC   Herráez-Aguilar Diego D   Aoiz F Javier FJ  

Proceedings of the National Academy of Sciences of the United States of America 20131223 1


Modern computational methods have become so powerful for predicting the outcome for the H + H2 → H2 + H bimolecular exchange reaction that it might seem further experiments are not needed. Nevertheless, experiments have led the way to cause theorists to look more deeply into this simplest of all chemical reactions. The findings are less simple. ...[more]

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