Using a tight binding model we calculate the conductance of monovalent atomic chains for different contact geometries. The leads connected to the chains are modelled as semi-infinite fcc lattices with different orientations and couplings. Our aim is twofold: To check the validity of a three-parametric conductance formula for differently oriented leads, and to investigate the geometry dependence of the conductance oscillations. We show that the character of these oscillations depends strongly on the geometry of the chain-lead coupling
In this study, we propose a recursive approach to study the transport properties of atomic wires. I...
We present a plane-wave/pseudopotential implementation of a method to calculate the electron transpo...
We investigate periodical oscillations in the conductance of suspended Au and Pt atomic chains durin...
Using a first-principles density-functional method we model electron transport through linear chains...
Using a first-principles density-functional method we model electron transport through linear chains...
Using first principles simulations we perform a detailed study of the structural, electronic, and tr...
We propose a mixed analytical–ab initio method for the accurate calculation of the conductance in mo...
We examine the conductance properties of a chain of Na atoms between two metallic leads in the limit...
A Friedel-sum-rule-aided first-principles conductance calculation is presented for a sodium monatomi...
A Friedel-sum-rule-aided first-principles conductance calculation is presented for a sodium monatomi...
A Friedel-sum-rule-aided first-principles conductance calculation is presented for a sodium monatomi...
We calculate the conductance of atomic chains as a function of their length. Using the Density Matri...
We review a new method, the embedding method, for calculating the residual conductance of an interac...
We study the stability of conductance oscillations in monatomic sodium wires with respect to structu...
Using a scanning tunnel microscope or mechanically controllable break junctions atomic contacts for ...
In this study, we propose a recursive approach to study the transport properties of atomic wires. I...
We present a plane-wave/pseudopotential implementation of a method to calculate the electron transpo...
We investigate periodical oscillations in the conductance of suspended Au and Pt atomic chains durin...
Using a first-principles density-functional method we model electron transport through linear chains...
Using a first-principles density-functional method we model electron transport through linear chains...
Using first principles simulations we perform a detailed study of the structural, electronic, and tr...
We propose a mixed analytical–ab initio method for the accurate calculation of the conductance in mo...
We examine the conductance properties of a chain of Na atoms between two metallic leads in the limit...
A Friedel-sum-rule-aided first-principles conductance calculation is presented for a sodium monatomi...
A Friedel-sum-rule-aided first-principles conductance calculation is presented for a sodium monatomi...
A Friedel-sum-rule-aided first-principles conductance calculation is presented for a sodium monatomi...
We calculate the conductance of atomic chains as a function of their length. Using the Density Matri...
We review a new method, the embedding method, for calculating the residual conductance of an interac...
We study the stability of conductance oscillations in monatomic sodium wires with respect to structu...
Using a scanning tunnel microscope or mechanically controllable break junctions atomic contacts for ...
In this study, we propose a recursive approach to study the transport properties of atomic wires. I...
We present a plane-wave/pseudopotential implementation of a method to calculate the electron transpo...
We investigate periodical oscillations in the conductance of suspended Au and Pt atomic chains durin...