5th Users' Conference of IT4Innovations

Session

Users' Talk III

9 Nov 2021, 13:00

Online (IT4Innovations)

80. A first-principles study of pressure-induced changes in magnetism of Ni-Mn-Sn alloys

Martin Friák (Institute of Physics of Materials, Czech Academy of Sciences, Brno, Czech Republic)

09/11/2021, 13:00

Users' talks

User's talk

We have performed a quantum-mechanical study of a series of stoichiometric Ni2MnSn structures focusing on pressure-induced changes in their magnetic properties. Our study concentrated on the role of point defects, in particular Mn-Ni, Mn-Sn and Ni-Sn swaps. For most defect types we also compared states with both ferromagnetic (FM) and anti-ferromagnetic (AFM) coupling between (i) the swapped...

86. FeSe superconductor with excess Fe: insight from first principles calculations

Karel Carva

09/11/2021, 13:20

Users' talks

User's talk

Iron-based unconventional superconductors with quasi-two-dimensional crystal structure have attracted intense interest after the critical temperature of FeSe was enhanced by more than one order of magnitude when thicknesses were reduced to the monolayer limit and placed on top of an insulating oxide substrate. In heterostructures comprising interfaces of FeSe with topological insulators,...

99. Antiferromagnetic magnons and local anisotropy: Dynamical mean-field study

Dr dominique Geffroy (Masaryk University, Brno.)

09/11/2021, 13:40

Users' talks

User's talk

We present a dynamical mean-field study of antiferromagnetic magnons in a one-, two-, and three-orbital Hubbard model of square and bcc cubic lattice at intermediate coupling strength. We investigate the effect of anisotropy introduced by an external magnetic field or single-ion anisotropy. For the latter we tune continuously between the easy-axis and easy-plane models. We also analyze a model...