activity
20152021
most citedSIESTA: recent developments and applications

544 citations · 576 across the 6 of their papers we have counts for

collaborators

9 papers

cond-mat.mes-hall2021★ 7 cited

Emergent chirality in a polar meron to skyrmion phase transition

Yu-Tsun Shao, Sujit Das, Zijian Hong +10

Polar skyrmions are predicted to emerge from the interplay of elastic, electrostatic and gradient energies, in contrast to the key role of the anti-symmetric Dzyalozhinskii-Moriya…

cond-mat.mtrl-sci2020★ 1 cited

Transferring Orbital Angular Momentum to an Electron Beam Reveals Toroidal and Chiral Order

Kayla X. Nguyen, Yi Jiang, Michael C. Cao +13

Orbital angular momentum and torque transfer play central roles in a wide range of magnetic textures and devices including skyrmions and spin-torque electronics(1-4). Analogous top…

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-sci2020★ 22 cited

First-principles study of two-dimensional electron and hole gases at the head-to-head and tail-to-tail 180 domain walls in PbTiO ferroelectric thin films

James Sifuna, Pablo García-Fernández, George S. Manyali +2

We study from first-principles the structural and electronic properties of head-to-head (HH) and tail-to-tail (TT) 180 domain walls in isolated free-standing PbTiO sl…

cond-mat.mtrl-sci2020

Comparison of band-fitting and Wannier-based model construction for WSe

James Sifuna, Pablo García-Fernández, George S. Manyali +2

Transition metal dichalcogenide materials are being thoroughly studied due to their novel two-dimensional structure, that is associated with exceptional opti…

cond-mat.mes-hall2019★ 2 cited

Novel mechanisms to enhance the capacitance beyond the classical limits in capacitors with free-electron-like electrodes

Javier Junquera, Pablo García-Fernández, Massimiliano Stengel

The so-called negative electron compressibility refers to the lowering of the chemical potential of a metallic system when the carrier density increases. This effect has often been…