Article ID Journal Published Year Pages File Type
5382344 Chemical Physics Letters 2012 6 Pages PDF
Abstract
► The rupture characteristics of organometallic complexes is tunable via the ligand. ► Electronic effects nontrivially impact rupture characteristics and materials design. ► The mechanism for bond rupture was found to be of closed-shell character. ► The initial response to tension is dominated by symmetric coordinative-bond-stretching. ► Rupture is concurrent with a sudden significant rearrangement of the ligands.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
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