2 papers
cond-mat.str-el2025
Electronic structure and x-ray magnetic circular dichroism in the quadruple perovskite CaCu3Re2Fe2O12
L. V. Bekenov, D. V. Mazur, B. F. Zhuravlev +3
We have studied the electronic and magnetic properties of the A- and B-site-ordered perovskite CaCu3Re2Fe2O12 within the density-functional theory using the generalized gradient ap…
cond-mat.mtrl-sci2023
Electronic structure and X-ray magnetic circular dichroism in the MAX phases TAlC (T=Ti and Cr) from first principles
L. V. Bekenov, S. V. Moklyak, B. F. Zhuravlev +2
We study the electronic and magnetic properties of TAlC (T=Ti and Cr) compounds in the density-functional theory using the generalized gradient approximation (GGA) with conside…