A photo-induced spin crossover based molecular switch and spin filter operating at room temperature
- 12 April 2021
- journal article
- research article
- Published by Royal Society of Chemistry (RSC) in Dalton Transactions
- Vol. 50 (19) , 6578-6587
Abstract
In this work, we performed a detailed study, by means of DFT and WFT methods, focused on the deposition of the NiTP–PAPy complex over an Au(111) surface, followed by DFT–NEGF calculations in order to probe the deposited complex transport properties.Keywords
Funding Information
- Fondo Nacional de Desarrollo Científico y Tecnológico (1171719)
- Departamento de Investigaciones Científicas y Tecnológicas, Universidad de Santiago de Chile (021941CJ_POSTDOC)
- Ministerio de Ciencia e Innovación (PGC2018-101689-B-I00 (MCI/AEI/FEDER,UE))
- Agencia Estatal de Investigación (PGC2018-101689-B-100)
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