CALCULATION OF EXCHANGE INTEGRALS OF VOLUME MAGNETIC CRYSTAL STRUCTURES Fe, Co, Ni AND CrNb3S6
М. В. МамоноваDostoevsky Omsk State UniversityВ. В. ПрудниковDostoevsky Omsk State UniversityП. В. ПрудниковDostoevsky Omsk State UniversityD. S. KalininDostoevsky Omsk State UniversityD. V. EvsinDostoevsky Omsk State University
2020en
ABI
Abstract
The results of calculations of magnetic moments and exchange integrals of bulk magneto-crystalline structures Fe, Co, Ni, and CrNb3S6 using the SPR-KKR package are presented. The influence of various crystal structures and approximations of the exchange-correlation potential is investigated.
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