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We evaluate the electronic, geometric and energetic properties of quasi 1-D wires formed by dangling bonds on Si(100)-H (2 x 1). The calculations are performed with density functional theory (DFT). Infinite wires are found to be insulating…

Materials Science · Physics 2012-11-26 Roberto Robles , Mikaël Kepenekian , Serge Monturet , Christian Joachim , Nicolás Lorente

New advances in single-atom manipulation are leading to the creation of atomic structures on H passivated Si surfaces with functionalities important for the development of atomic and molecular based technologies. We perform total-energy and…

Materials Science · Physics 2015-06-22 Mikaël Kepenekian , Roberto Robles , Riccardo Rurali , Nicolás Lorente

Transport through a one-dimensional wire of interacting electrons connected to semi infinite leads is investigated using a bosonization approach. The dynamic nonlocal conductivity is rigorously expressed in terms of the transmission. For…

Mesoscale and Nanoscale Physics · Physics 2008-02-03 Inès Safi , H. J. Schulz

We perform electronic structure and quantum transport studies of dangling bond loops created on H-passivated Si(100) surfaces and connected to carbon nanoribbon leads. We model loops with straight and zigzag topologies as well as with…

Mesoscale and Nanoscale Physics · Physics 2015-06-24 Andrii Kleshchonok , Rafael Gutierrez , Gianaurelio Cuniberti

Despite the importance of Si:P delta-doped wires for modern nanoelectronics, there are currently no computational models of electron transport in these devices. In this paper we present a nonequilibrium Green's function model for electronic…

Mesoscale and Nanoscale Physics · Physics 2016-01-20 J. S. Smith , D. W. Drumm , A. Budi , J. A. Vaitkus , J. H. Cole , S. P. Russo

We present an extension of the work of D'Amato and Pastawski on electron transport in a one-dimensional conductor modeled by the tight binding lattice Hamiltonian and in which inelastic scattering is incorporated by connecting each site of…

Mesoscale and Nanoscale Physics · Physics 2009-11-11 Dibyendu Roy , Abhishek Dhar

Bare silicon dimers on hydrogen-terminated Si(100) have two dangling bonds. These are atomically localized regions of high state density near to and within the bulk silicon band gap. We studied bare silicon dimers as monomeric units.…

Dangling bond wires on Si(001) are prototypical one dimensional wires, which are expected to show polaronic and solitonic effects. We present electronic structure calculations, using the tight binding model, of solitons in dangling-bond…

Materials Science · Physics 2009-11-10 C. F. Bird , A. J. Fisher , D. R. Bowler

Transport through a one--dimensional wire of interacting electrons connected to semi--infinite leads is investigated using a bosonization approach. An incident electron is transmitted as a sequence of partial charges. The dc conductance is…

Condensed Matter · Physics 2009-10-28 I. Safi , H. J. Schulz

A structural model of hydrogenated amorphous silicon containing an isolated dangling bond is used to investigate the effects of electron interactions on the electronic level splittings, localization of charge and spin, and fluctuations in…

Materials Science · Physics 2009-11-07 R. G. Hennig , P. A. Fedders , A. E. Carlsson

We consider electron transport in a model of a spinless superconductor described by a Kitaev type lattice Hamiltonian where the electron interactions are modelled through a superconducting pairing term. The superconductor is sandwiched…

Superconductivity · Physics 2021-01-04 Junaid Majeed Bhat , Abhishek Dhar

It has long been anticipated that the ultimate in miniature circuitry will be crafted of single atoms. Despite many advances made in scanned probe microscopy studies of molecules and atoms on surfaces, challenges with patterning and limited…

Electronic transport is theoretically investigated in laterally confined semiconductor superlattices using the formalism of non-equilibrium Green's functions. The transport properties are calculated for nanowire superlattices of varying…

Mesoscale and Nanoscale Physics · Physics 2014-04-25 Thomas Grange

First principle calculations of the conductance of gold wires containing 3-8 atoms each with 2.39 {\AA} bond length were performed using density functional theory. Three different configuration of wire/electrodes were used. For zigzag wire…

We consider the problem of electron transport across a quasi-one-dimensional disordered multiply-scattering medium, and study the statistical properties of the electron density inside the system. In the physical setup that we contemplate,…

Disordered Systems and Neural Networks · Physics 2020-01-29 Pier A. Mello , Miztli Yépez

We investigate electron transport through a mono-atomic wire which is tunnel coupled to two electrodes and also to the underlying substrate. The setup is modeled by a tight-binding Hamiltonian and can be realized with a scanning tunnel…

Mesoscale and Nanoscale Physics · Physics 2010-11-25 Tomasz Kwapinski , Sigmund Kohler , Peter Hanggi

We study the transport properties of a long non-uniform quantum wire where the electron-electron interactions and the density vary smoothly at large length scales. We show that these inhomogeneities lead to a finite resistivity of the wire,…

Mesoscale and Nanoscale Physics · Physics 2008-04-08 J. Rech , K. A. Matveev

We investigate transport of spinless fermions through a single site dot junction of M one-dimensional quantum wires. The semi-infinite wires are described by a tight-binding model. Each wire consists of two parts: the non-interacting leads…

Strongly Correlated Electrons · Physics 2009-11-11 X. Barnabe-Theriault , A. Sedeki , V. Meden , K. Schoenhammer

We theoretically study transport properties of a two-dimensional electron system on a hydrogen-passivated Si(111) surface in the field-effect-transistor (FET) configuration. We calculate the density and temperature dependent mobility and…

Materials Science · Physics 2009-11-11 E. H. Hwang , S. Das Sarma

We present a quantitative analysis of the steady state electronic transport in a resistive switching device. The device is composed of a thin film of Ag$_{2}$S (solid electrolyte) contacted by a Pt nano-contact acting as ion-blocking…

Materials Science · Physics 2017-12-11 Monica Morales-Masis , Hans-Dieter Wiemhofer , Jan M. van Ruitenbeek
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