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The electron transport properties of a four-terminal molecular device are computed within the framework of density functional theory and non-equilibrium Keldysh theory. The additional two terminals lead to new properties, including a…

介观与纳米尺度物理 · 物理学 2009-09-01 Kamal K. Saha , Wenchang Lu , J. Bernholc , Vincent Meunier

The well-established symmetry relations for linear transport phenomena can not, in general, be applied in the non-linear regime. Here we propose a set of symmetry relations with respect to bias voltage and magnetic field for the non-linear…

介观与纳米尺度物理 · 物理学 2015-06-24 A. Lofgren , C. A. Marlow , I. Shorubalko , R. P. Taylor , P. Omling , L. Samuelson , H. Linke

Two electrons at the threshold of ionization represent a severe test case for electronic structure theory. A pseudospectral method yields a very accurate density of the two-electron ion with nuclear charge close to the critical value.…

化学物理 · 物理学 2014-08-12 Paul E. Grabowski , Kieron Burke

We investigate the electronic transport through a molecule in the Kondo regime. The tunneling between the electrode and the molecule is asymmetrically modulated by the oscillations of the molecule, i.e., if the molecule gets closer to one…

介观与纳米尺度物理 · 物理学 2008-12-09 J. Mravlje , A. Ramsak

Transport in an ideal two-dimensional quantum spin Hall device is dominated by the counterpropagating edge states of electrons with opposite spins, giving the universal value of the conductance, $2e^2/h$. We study the effect on the…

介观与纳米尺度物理 · 物理学 2011-06-14 Yoichi Tanaka , A. Furusaki , K. A. Matveev

We present transport measurements on a lateral double dot produced by combining local anodic oxidation and electron beam lithography. We investigate the tunability of our device and demonstrate, that we can switch between capacitive and…

介观与纳米尺度物理 · 物理学 2007-05-23 M. C. Rogge , C. Fuhner , U. F. Keyser , R. J. Haug

Conductance measurements of a molecular wire, contacted between an epitaxial molecule-metal bond and the tip of a scanning tunneling microscope, are reported. Controlled retraction of the tip gradually de-hybridizes the molecule from the…

强关联电子 · 物理学 2024-02-05 R. Temirov , A. C. Lassise , F. Anders , F. S. Tautz

Molecules of bisthiolterthiophene have been adsorbed on the two facing gold electrodes of a mechanically controllable break junction in order to form metal-molecule(s)-metal junctions. Current-voltage (I-V) characteristics have been…

介观与纳米尺度物理 · 物理学 2009-10-31 C. Kergueris , J. -P. Bourgoin , S. Palacin , D. Esteve , C. Urbina , M. Magoga , C. Joachim

A local-orbital based ab initio approach to obtain the Green function for large heterogeneous systems is developed. First a Green function formalism is introduced based on exact diagonalization. Then the self energy is constructed from an…

介观与纳米尺度物理 · 物理学 2007-05-23 M. Albrecht , A. Schnurpfeil , G. Cuniberti

Based on a recent proposal [O.P. Sushkov, Phys. Rev. B 64, 155319 (2001)], we relate the quantum conductance through a sample in which electrons are strongly correlated to the persistent current of a large ring, composed of the sample and a…

We present a theory of tunneling and resonant transitions in one-dimensional molecular systems which is based on Green's function theory of electron sub-barrier scattering off the structural units (or functional groups) of a molecular…

其他凝聚态物理 · 物理学 2007-05-23 I. I. Oleynik , M. A. Kozhushner , V. S. Posvyanskii

Electron transport experiments on two lateral quantum dots coupled in series are reviewed. An introduction to the charge stability diagram is given in terms of the electrochemical potentials of both dots. Resonant tunneling experiments show…

介观与纳米尺度物理 · 物理学 2009-11-07 W. G. van der Wiel , S. De Franceschi , J. M. Elzerman , T. Fujisawa , S. Tarucha , L. P. Kouwenhoven

We study quantum transport in a periodically driven (Floquet) topological system coupled to static fermionic reservoirs. Using the Floquet nonequilibrium Green's-function (NEGF) formalism we show, from exact numerics for a strip geometry,…

介观与纳米尺度物理 · 物理学 2026-05-14 Rekha Kumari , Manas Kulkarni , Abhishek Dhar

Tunneling of electrons between two $\nu = 1/2$ quantum Hall parallel planes is studied. In order to calculate the physical electron Green's function, the Chern-Simons gauge field formalism is used, both in a perturbative many-body…

凝聚态物理 · 物理学 2007-05-23 David Lidsky

We report a full self-consistent ab initio calculation of the conductance of a diarylethene-based molecular switch with two graphene electrodes. Our result show the contributions of the resonant states of the molecule, of the electrode…

介观与纳米尺度物理 · 物理学 2015-05-28 C. Motta , M. I. Trioni , G. P. Brivio , K. L. Sebastian

The derivative discontinuity of the exchange-correlation functional of density-functional theory is cast as the difference of two types of electron affinities. We show that standard Kohn-Sham calculations can be used to calculate both…

化学物理 · 物理学 2007-12-13 F. P. Rosselli , A. B. F. da Silva , K. Capelle

We study conductance across a twisted bilayer graphene coupled to single-layer graphene leads in two setups: a flake of graphene on top of an infinite graphene ribbon and two overlapping semi-infinite graphene ribbons. We find conductance…

介观与纳米尺度物理 · 物理学 2020-07-30 Hadi Z. Olyaei , Bruno Amorim , Pedro Ribeiro , Eduardo V. Castro

The conductance through a serial double dot structure for which the inter-dot tunneling is stronger than the tunneling to the leads is studied using the numerical density matrix renormalization group method and analytic arguments. When the…

介观与纳米尺度物理 · 物理学 2007-05-23 Richard Berkovits , Boris Altshuler

We report an investigation of electron conduction in oligophenyl based double barrier molecular device. We have carried out analytical calculations and numerical simulations on isolated molecules, consisting of aromatic "pi" conjugated…

材料科学 · 物理学 2010-07-14 Aranya B Bhattacherjee , Suman Dudeja

Many-body transport has emerged as an efficient tool for understanding interaction effects in quantum materials with a multi-band electronic structure. This paper proposes a formula for the two-particle transmission coefficient for…

超导电性 · 物理学 2023-02-02 G. Tkachov
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