Article ID Journal Published Year Pages File Type
5394864 Computational and Theoretical Chemistry 2012 7 Pages PDF
Abstract
► The mechanism of Se + H2Se reaction has been investigated on the triplet and singlet PESs, theoretically. ► There are two intersystem crossings between triplet and singlet PESs. ► HSeSeH is the main product of Se + H2Se reaction.
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Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
Computational study on mechanism of hydrogen abstraction and selenium insertion in the reaction of triplet and singlet selenium atom with hydrogen selenide
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