Article ID Journal Published Year Pages File Type
5389190 Chemical Physics Letters 2009 5 Pages PDF
Abstract
The intrinsical mechanism for the second-order response of organometallic W(CO)5DAS chromophore has been revisited and ascribed to metal-to-ligand charge transfer contribution by the DFT/TDDFT computations. The solvent sensitivity and potential applications as molecular switch devices are discussed.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
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