The Contribution of Density Functional Theory to the Atomistic Knowledge of Electrochromic Processes

Autor: Bruna Clara De Simone, Marta Erminia Alberto, Tiziana Marino, Nino Russo, Marirosa Toscano

Publikováno v: Molecules, Vol 26, Iss 19, p 5793 (2021)

In this review, we provide a brief overview of the contribution that computational studies can offer to the elucidation of the electronic mechanisms responsible for the electrochromism phenomenon, through the use of the density functional theory (DFT

Externí odkaz: https://doaj.org/article/827ff552bc6747ea945203bea7f2e45f

Time-Dependent Density Functional Computations of the Spectrochemical Properties of Dithiolodithiole and Thiophene Electrochromic Systems

Autor: Nino Russo, Gloria Mazzone, Bruna Clara De Simone, Marirosa Toscano, Tiziana Marino

Publikováno v: Materials, Vol 10, Iss 9, p 981 (2017)
Materials; Volume 10; Issue 9; Pages: 981
Materials

The importance of organic electrochromic materials has grown considerably in recent decades due to their application in smart window, automotive, and aircraft technologies. Theoretical prediction of the optical properties should contribute to their b

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::bdd3b40564483abd6d9f670d95245aa9
https://doi.org/10.3390/ma10090981

Testing of electrochromic materials using symmetrical devices

Autor: Carole Gentilhomme, Marc Ast, Christine Lefrou

Publikováno v: Journal of Applied Electrochemistry
Journal of Applied Electrochemistry, Springer Verlag, 2006, 36 (9), pp. 1011-1019. ⟨10.1007/s10800-006-9169-0⟩

International audience; “Symmetric materials” devices, where both electrodes are made of the same electrochromic materials, allow the in situ study of side reactions. Each transferred charge that is not used for the expected electrochromic reaction

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::2d89d377536f318cbc3e9672ded00513
https://hal.archives-ouvertes.fr/hal-00333490

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