Zobrazeno 1 - 10
of 59
pro vyhledávání: '"Buerkle, Marius"'
Akademický článek
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Autor:
Li, Yueqi, Buerkle, Marius, Li, Guangfeng, Rostamian, Ali, Wang, Hui, Wang, Zixiao, Bowler, David R., Miyazaki, Tsuyoshi, Asai, Yoshihiro, Zhou, Gang, Tao, Nongjian
Quantum interference can profoundly affect charge transport in single molecules, but experiments can usually measure only the conductance at the Fermi energy. Because in general the most pronounced features of the quantum interference are not located
Externí odkaz:
http://arxiv.org/abs/1806.00124
Autor:
Haq, Atta ul, Buerkle, Marius, Alessi, Bruno, Svrcek, Vladimir, Maguire, Paul, Mariotti, Davide
Publikováno v:
Nanoscale Horizons; Nov2024, Vol. 9 Issue 11, p2042-2050, 9p
Akademický článek
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Autor:
Dsouza, Slavia Deeksha, Buerkle, Marius, Brunet, Paul, Maddi, Chiranjeevi, Padmanaban, Dilli Babu, Morelli, Alessio, Payam, Amir Farokh, Maguire, Paul, Mariotti, Davide, Svrcek, Vladimir
Publikováno v:
In Carbon 15 October 2021 183:1-11
Autor:
García, Raúl, Herranz, M. Ángeles, Leary, Edmund, González, M. Teresa, Bollinger, Gabino Rubio, Bürkle, Marius, Zotti, Linda A., Asai, Yoshihiro, Pauly, Fabian, Cuevas, Juan Carlos, Agraït, Nicolás, Martín, Nazario
Publikováno v:
Beilstein J.Org.Chem.2015,11,1068-1078
We describe the synthesis and single molecule electrical transport properties of a molecular wire containing a ${\pi}$-extended tetrathiafulvalene (exTTF) group and its charge-transfer complex with F4TCNQ. We form single molecule junctions using the
Externí odkaz:
http://arxiv.org/abs/1506.07748
Publikováno v:
Phys. Rev. B 91, 165419 (2015)
Here we present a theoretical study of the thermoelectric transport through {[}2,2{]}para\-cyclo\-phane-based single-molecule junctions. Combining electronic and vibrational structures, obtained from density functional theory (DFT), with nonequilibri
Externí odkaz:
http://arxiv.org/abs/1503.02134
Autor:
Buerkle, Marius1 (AUTHOR) marius.buerkle@aist.go.jp, Lozac'h, Mickaël1 (AUTHOR), Mariotti, Davide2 (AUTHOR), Švrček, Vladimir1 (AUTHOR)
Publikováno v:
Scientific Reports. 3/22/2023, Vol. 13 Issue 1, p1-7. 7p.
Autor:
Bürkle, Marius, Viljas, Janne K., Hellmuth, Thomas J., Scheer, Elke, Weigend, Florian, Schön, Gerd, Pauly, Fabian
Publikováno v:
Phys. Status Solidi B 250, 2468 (2013)
In this article we present a novel semi-analytical approach to calculate first-order electron-vibration coupling constants within the framework of density functional theory. It combines analytical expressions for the first-order derivative of the Koh
Externí odkaz:
http://arxiv.org/abs/1309.4552
Autor:
Zotti, Linda Angela, Bürkle, Marius, Pauly, Fabian, Lee, Woochul, Kim, Kyeongtae, Jeong, Wonho, Asai, Yoshihiro, Reddy, Pramod, Cuevas, Juan Carlos
Publikováno v:
New J. Phys. 16, 015004 (2014)
Motivated by recent experiments [Lee et al. Nature 498, 209 (2013)], we present here a detailed theoretical analysis of the Joule heating in current-carrying single-molecule junctions. By combining the Landauer approach for quantum transport with ab
Externí odkaz:
http://arxiv.org/abs/1307.8336