activity
20042018
most citedAtomic self-interaction correction for molecules and solids

167 citations · 793 across the 16 of their papers we have counts for

collaborators

16 papers

cond-mat.mtrl-sci2018★ 20 cited

Search for alternative magnetic tunnel junctions based on all-Heusler stacks

Worasak Rotjanapittayakul, Jariyanee Prasongkit, Ivan Rungger +3

By imposing the constraints of structural compatibility, stability and a large tunneling magneto-resistance, we have identified the FeAl/BiF/FeAl stack as a possible al…

cond-mat.mtrl-sci2017★ 1 cited

Designing magnetism in Fe-based Heusler alloys: a machine learning approach

Mario Žic, Thomas Archer, Stefano Sanvito

Combining material informatics and high-throughput electronic structure calculations offers the possibility of a rapid characterization of complex magnetic materials. Here we demon…

cond-mat.mtrl-sci2015★ 49 cited

Designing a fully-compensated half-metallic ferrimagnet

Mario Zic, Karsten Rode, Naganivetha Thiyagarajah +8

Recent experimental work on Mn2RuxGa demonstrates its potential as a compensated ferrimagnetic half-metal (CFHM).Here we present a set of high-throughput ab initio density function…

cond-mat.mtrl-sci2013★ 89 cited

Spin-filtering efficiency of ferrimagnetic spinels CoFe2O4 and NiFe2O4

Nuala M. Caffrey, Daniel Fritsch, Thomas Archer +2

We assess the potential of the ferrimagnetic spinel ferrites CoFe2O4 and NiFe2O4 to act as spin filtering barriers in magnetic tunnel junctions. Our study is based on the electroni…

cond-mat.mtrl-sci2012★ 50 cited

Coexistance of giant tunneling electroresistance and magnetoresistance in an all-oxide magnetic tunnel junction

Nuala Mai Caffrey, Thomas Archer, Ivan Rungger +1

We demonstrate with first-principles electron transport calculations that large tunneling magnetoresistance (TMR) and tunneling electroresistance (TER) effects can coexist in an al…

cond-mat.str-el2011★ 88 cited

Exchange interactions and magnetic phases of transition metal oxides: benchmarking advanced ab initio methods

T. Archer, C. D. Pemmaraju, S. Sanvito +8

The magnetic properties of the transition metal monoxides MnO and NiO are investigated at equilibrium and under pressure via several advanced first-principles methods coupled with…