most citedStudy of the volume and spin collapse in orthoferrite LuFeO_3 using LDA+U

28 citations · 28 across the 2 of their papers we have counts for

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2 papers

cond-mat.str-el2009★ 28 cited

Study of the volume and spin collapse in orthoferrite LuFeO_3 using LDA+U

Donat J. Adams, Bernard Amadon

Rare earth (R) orthoferrites RFeO_3 exhibit large volume transitions associated with a spin collapse. We present here ab initio calculations on LuFeO_3. We show that taking into ac…

cond-mat.str-el2009

First-principles study of the effect of Fe impurities in MgO at geophysically relevant pressures

Donat J. Adams, W. M. Temmerman, Z. Szotek

The self-interaction corrected local spin density (SIC-LSD) formalism and the standard GGA treatment of the exchange-correlation energy have been applied to study the collapse of t…