activity
20122025
most citedSIESTA: recent developments and applications

544 citations · 701 across the 10 of their papers we have counts for

collaborators

10 papers

cond-mat.mtrl-sci2025

Composition-driven magnetic anisotropy and spin polarization in MnRuGa Heusler alloy

Ramón Cuadrado

We present a comprehensive investigation of the influence of Ru concentration on the lattice parameters, atomic magnetic moments, electronic structure, and magnetic anisotropy ener…

cs.SI2023★ 1 cited

Raphtory: The temporal graph engine for Rust and Python

Ben Steer, Naomi Arnold, Cheick Tidiane Ba +15

Raphtory is a platform for building and analysing temporal networks. The library includes methods for creating networks from a variety of data sources; algorithms to explore their…

cond-mat.mes-hall2022

Electrical Control of Spin-polarized Topological Currents in Monolayer WTe

Jose H. Garcia, Jinxuan You, Monica García-Mota +6

We evidence the possibility for coherent electrical manipulation of the spin orientation of topologically protected edge states in a low-symmetry quantum spin Hall insulator. By us…

physics.comp-ph2020★ 544 cited

SIESTA: recent developments and applications

Alberto García, Nick Papior, Arsalan Akhtar +33

A review of the present status, recent enhancements, and applicability of the SIESTA program is presented. Since its debut in the mid-nineties, SIESTA's flexibility, efficiency and…

cond-mat.mtrl-sci2016★ 52 cited

Graphene-based synthetic antiferromagnets and ferrimagnets

P. Gargiani, R. Cuadrado, H. B. Vasili +2

Hybrid Graphene/magnetic structures offer a unique playground for fundamental research, and opportunities for emerging technologies. Graphene-spaced ultrathin structures with antif…

cond-mat.mtrl-sci2014★ 2 cited

Interaction potential of FePt with the MgO(001) surface

Ramon Cuadrado, Roy W. Chantrell

By means of density functional theory we have undertaken a structural, electronic and magnetic survey of the adsorption of the Fe_xPt_y(x,y=<4) clusters on MgO (001) surface under…

cond-mat.mtrl-sci2014★ 32 cited

Magnetic anisotropy of Fe_1-yX_yPt-L10 [X=Cr,Mn,Co,Ni,Cu] bulk alloys

R. Cuadrado, Timothy J. Klemmer, R. W. Chantrell

We demonstrate by means of fully relativistic first principles calculations that, by substitution of Fe by Cr, Mn, Co, Ni or Cu in FePt-L10 bulk alloys, with fixed Pt content, it i…

cond-mat.mtrl-sci2013★ 14 cited

Interface magnetic moments enhancement of FePt-L1/MgO(001): an ab-initio study

R Cuadrado, R W Chantrell

The interface between FePt--L1 and MgO(001) alloys has been studied using density functional calculations. Because the stacking of the face-centered tetragonal L1 phase is…

cond-mat.mtrl-sci2013★ 32 cited

Exchange coupling and magnetic anisotropy at Fe/FePt interfaces

C J Aas, P J Hasnip, R Cuadrado +4

We perform fully relativistic first principles calculations of the exchange interactions and the magnetocrystalline anisotropy energy (MAE) in an Fe/FePt/Fe sandwich system in orde…

cond-mat.mtrl-sci2012★ 24 cited

Electronic and magnetic properties of bimetallic L1 cuboctahedral clusters by means of a fully relativistic density functional based calculations

R. Cuadrado, R. W. Chantrell

By means of density functional theory (DFT) and the generalized gradient approximation (GGA) we present a structural, electronic and magnetic study of FePt, CoPt, FeAu and FePd bas…