Zobrazeno 1 - 10
of 825
pro vyhledávání: '"Thijssen, J. M."'
Autor:
Abel I. López Forero
Publikováno v:
Historia Crítica. :232-247
Autor:
Verzijl, C. J. O., Gil, J. A. Celis, Perrin, M. L., Dulić, D., van der Zant, H. S. J., Thijssen, J. M.
Publikováno v:
J. Chem. Phys. 143, 174106 (2015)
We present a method for incorporating image-charge effects into the description of charge transport through molecular devices. A simple model allows us to calculate the adjustment of the transport levels, due to the polarization of the electrodes as
Externí odkaz:
http://arxiv.org/abs/1511.06413
Publikováno v:
Nano Lett., 2015, 15 (8), pp 5569-5573
It is understood that molecular conjugation plays an important role in charge transport through single-molecule junctions. Here, we investigate electron transport through an anthraquinone based single-molecule three-terminal device. With the use of a
Externí odkaz:
http://arxiv.org/abs/1507.08913
Publikováno v:
J. Chem. Phys. 142, 084703 (2015)
Quantum interference (QI) effects in molecular junctions may be used to obtain large thermoelectric responses. We study the electrical conductance G and the thermoelec- tric response of a series of molecules featuring a quinoid core using density fun
Externí odkaz:
http://arxiv.org/abs/1507.00179
Publikováno v:
Journal of Chemical Physics; May2023, Vol. 158 Issue 17, p1-10, 10p
Autor:
Perrin, M. L., Verzijl, C. J. O., Martin, C. A., Shaikh, A. J., Eelkema, R., van Esch, J. H., van Ruitenbeek, J. M., Thijssen, J. M., van der Zant, H. S. J., Dulić, D.
Publikováno v:
Nature Nanotechnology 8, 282-287 (2013)
The characteristics of molecular electronic devices are critically determined by metal-organic interfaces, which influence the arrangement of the orbital levels that participate in charge transport. Studies on self-assembled monolayers (SAMs) show (m
Externí odkaz:
http://arxiv.org/abs/1403.4266
Publikováno v:
J. Chem. Phys. 138, 094102 (2013)
Transport properties of molecular junctions are notoriously expensive to calculate with ab initio methods, primarily due to the semi-infinite electrodes. This has led to the introduction of different approximation schemes for the electrodes. For the
Externí odkaz:
http://arxiv.org/abs/1403.3861
Autor:
Verzijl, C. J. O., Thijssen, J. M.
Publikováno v:
J. Phys. Chem. C, 2012, 116 (46), pp 24393-24412
We present a novel implementation of the first-principles approach to molecular charge transport using the non-equilibrium Green's function formalism in combination with the ADF/BAND periodic band-structure DFT code, together with results for several
Externí odkaz:
http://arxiv.org/abs/1403.3860