4 papers
Charge disproportionation and spin ordering in LiVO and NaVO: a distributed moment point of view
Claudio Garcia, Ilteris K. Turan, Jerome Jackson +3
The effects of charge disproportionation between V and V on the exchange interactions and related magnetic, electronic and optical properties are studied in LiVO$…
Magnetic exchange interactions in the molecular orbital spin system NaV2O5 from a distributed moment point of view
Claudio Garcia, Ilteris K. Turan, Swagata Acharya +3
The magnetism in NaV2O5 results from doping of the narrow split-off conduction band of V2O5, which becomes half-filled and leads to a Mott-insulating splitting of spin resolved ban…
Electronic band structure and exciton properties of CaSnN
Ilteris K. Turan, Sarker Md. Sadman, Walter R. L. Lambrecht
The electronic band structure of CaSnN in the wurtzite-based structure is calculated using the Quasiparticle Self-consistent (QS)GW method, including ladder di…
Electronic structure and exchange interactions in altermagnetic MnGeP in the quasiparticle-self-consistent approach
Ilteris K. Turan, Walter R L. Lambrecht, Jerome Jackson
The QS method is used to study the electronic band structure, optical dielectric function, and exchange interactions in chalcopyrite, , structure MnGeP. The mat…