Article ID Journal Published Year Pages File Type
5384504 Chemical Physics Letters 2011 6 Pages PDF
Abstract
► The mechanism of the MgH + H→Mg + H2 reaction was studied with quantum dynamics methods. ► Both direct and complex formation mechanisms are playing a role in the dynamics. ► The HMgH complex decays into Mg + H2 via a so-called “roaming mechanism”.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
Roaming dynamics in the MgH + H→Mg + H2 reaction: Quantum dynamics calculations
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