321 citations · 1.3k across the 38 of their papers we have counts for
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Determination of effective microscopic models for the frustrated antiferromagnets CsCuCl and CsCuBr by density functional methods
Kateryna Foyevtsova, Ingo Opahle, Yu-Zhong Zhang +2
We investigate the electronic and magnetic properties of the frustrated triangular-lattice antiferromagnets CsCuCl and CsCuBr in the framework of density functional…
Comparative study of FeCr2S4 and FeSc2S4: Spinels with orbitally active A site
S. Sarkar, T. Maitra, Roser Valentí +1
Using first-principles density functional calculations, we perform a comparative study of two Fe based spinel compounds, FeCr2S4 and FeSc2S4. Though both systems contain an orbital…
Local moments and symmetry breaking in metallic PrMnSbO
Simon A. J. Kimber, Adrian H. Hill, Yu-Zhong Zhang +7
We report a combined experimental and theoretical investigation of the layered antimonide PrMnSbO which is isostructural to the parent phase of the iron pnictide superconductors. W…
Modulation of pairing interaction in BiSrCaCuO by an O dopant: a density functional theory study
Kateryna Foyevtsova, H. C. Kandpal, Harald O. Jeschke +4
Scanning tunneling spectroscopy measurements on the high temperature superconductor BiSrCaCuO have reported an enhanced spectral gap in the neighborhood of O do…