Geometry of Molecular Motions in Dye Monolayers at Various Coverages
Molecular motion in monolayers is thought to influence the kinetics of charge transport and recombination in systems such as dye-sensitized solar cells (DSSCs). In this work, we use ab initio molecular dynamics to evaluate the geometry and time scale of such molecular motion in a D102 monolayer. D10...
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Format: | Article |
Language: | en_US |
Published: |
American Chemical Society (ACS)
2018
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Online Access: | http://hdl.handle.net/1721.1/115102 https://orcid.org/0000-0003-1487-2910 https://orcid.org/0000-0001-7111-0176 |