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Dipolar molecules inside C-70: an electric field-driven room-temperature single-molecule switch
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SYSNO ASEP 0467206 Document Type J - Journal Article R&D Document Type Journal Article Subsidiary J Článek ve WOS Title Dipolar molecules inside C-70: an electric field-driven room-temperature single-molecule switch Author(s) Foroutan-Nejad, C. (CZ)
Andrushchenko, Valery (UOCHB-X) RID, ORCID
Straka, Michal (UOCHB-X) RID, ORCIDSource Title Physical Chemistry Chemical Physics. - : Royal Society of Chemistry - ISSN 1463-9076
Roč. 18, č. 48 (2016), s. 32673-32677Number of pages 5 s. Language eng - English Country GB - United Kingdom Keywords room-temperature single-molecule switch ; electric field ; endohedral fullerene ; density functional calculations Subject RIV CF - Physical ; Theoretical Chemistry R&D Projects GA14-03564S GA ČR - Czech Science Foundation (CSF) Institutional support UOCHB-X - RVO:61388963 UT WOS 000390435800006 DOI 10.1039/c6cp06986j Annotation We propose a two-state electric field-driven room-temperature single-molecule switch based on a dipolar molecule enclosed inside ellipsoidal fullerene C-70. We show that the two low-energy minima of the molecular dipole inside the C-70 cage provide distinguishable molecular states of the system that can be switched by application of an external electric field. Workplace Institute of Organic Chemistry and Biochemistry Contact asep@uochb.cas.cz ; Kateřina Šperková, Tel.: 232 002 584 ; Viktorie Chládková, Tel.: 232 002 434 Year of Publishing 2017 Electronic address http://pubs.rsc.org/en/content/articlepdf/2016/cp/c6cp06986j
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