71 citations · 127 across the 4 of their papers we have counts for
4 papers
Coulomb blockade in electron transport through a C molecule from first principles
J. J. Palacios
We present results of spin-unrestricted first-principles quantum transport for a gated C molecule weakly contacted to Al electrodes, making emphasis on the role played by th…
Magnetic and orbital blocking in Ni nanocontacts
David Jacob, J. Fernández-Rossier, J. J. Palacios
We address the fundamental question of whether magneto-resistance (MR) of atomic-sized contacts of Nickel is very large because of the formation of a domain wall (DW) at the neck.…
Implementing the Keldysh formalism into the ab initio Gaussian Embedded Cluster Method for the calculation of quantum transport
E. Louis, J. A. Verges, J. J. Palacios +2
We discuss the key steps that have to be followed to calculate quantum transport out of equilibrium by means of the {\it ab initio} Gaussian Embedded Cluster Method recently develo…
Analysis of Scanning Tunneling Spectroscopy Experiments from First Principles: the Test Case of C60 Adsorbed on Au(111)
A. J. Perez-Jimenez, J. J. Palacios, E. Louis +2
We report on the first principles determination of the conductance properties of Buckminster fullerene adsorbed on a gold surface, comparing them with recent Scanning Tunneling Mic…