First principles studies of the Gilbert damping and exchange interactions for half-metallic Heuslers alloys
arXiv:1604.07552 · doi:10.1103/PhysRevB.93.214439
Abstract
Heusler alloys have been intensively studied due to the wide variety of properties that they exhibit. One of these properties is of particular interest for technological applications, i.e. the fact that some Heusler alloys are half-metallic. In the following, a systematic study of the magnetic properties of three different Heusler families , and with is performed. A key aspect is the determination of the Gilbert damping from first principles calculations, with special focus on the role played by different approximations, the effect that substitutional disorder and temperature effects. Heisenberg exchange interactions and critical temperature for the alloys are also calculated as well as magnon dispersion relations for representative systems, the ferromagnetic and the ferrimagnetic . Correlations effects beyond standard density-functional theory are treated using both the local spin density approximation including the Hubbard and the local spin density approximation plus dynamical mean field theory approximation, which allows to determine if dynamical self-energy corrections can remedy some of the inconsistencies which were previously reported for these alloys.
References in corpus (32)
- Electronic Structure Calculations with Dynamical Mean-Field Theory: A Spectral Density Functional Approach
- Slater-Pauling Behavior of the Half-Ferromagnetic Full-Heusler Alloys
- Half-metallic ferromagnets: From band structure to many-body effects
- Calculated electronic and magnetic properties of the half-metallic, transition metal based Heusler compounds
- Ab initio calculations of quasiparticle band structure in correlated systems: LDA++ approach
- Geometric, electronic, and magnetic structure of CoFeSi: Curie temperature and magnetic moment measurements and calculations
- Ab-initio calculations of exchange interactions, spin-wave stiffness constants, and Curie temperatures of Fe, Co, and Ni
- Correlated metals and the LDA+U method
- A method for atomistic spin dynamics simulations: implementation and examples
- Exchange interactions and temperature dependence of the magnetization in half--metallic Heusler alloys
- Properties of the quaternary half-metal-type Heusler alloy CoMnFeSi
- First- principle calculations of magnetic interactions in correlated systems
- Ab-initio calculation of the Gilbert damping parameter via linear response formalism
- Theory of quasiparticle spectra for Fe, Co, and Ni: bulk and surface
- Search for half-metallic ferrimagnetism in V-based Heusler alloys MnVZ (ZAl, Ga, In, Si, Ge, Sn)
- First-principles calculation of the Gilbert damping parameter via the linear response formalism with application to magnetic transition-metals and alloys
- Substituting the main group element in cobalt - iron based Heusler alloys: CoFeAlSi
- Calculating linear response functions for finite temperatures on the basis of the alloy analogy model
- Double Counting in LDA+DMFT - The Example of NiO
- Electronic structure and magnetic properties of correlated metals: A local self-consistent perturbation scheme
- Charge self-consistent dynamical mean-field theory based on the full-potential linear muffin-tin orbital method: methodology and applications
- Non-quasiparticle states in CoMnSi evidenced through magnetic tunnel junction spectroscopy measurements
- Direct evidence for minority spin gap in the Co2MnSi Heusler alloy
- Doping and disorder in the CoMnAl and CoMnGa half-metallic Heusler alloys
- Co2FeAl Heusler thin films grown on Si and MgO substrates: annealing temperature effect
- Electron correlations in CoMnFeSi Heusler compounds
- Ab-initio calculation of the effective on-site Coulomb interaction parameters for half-metallic magnets
- Determination of exchange constants of Heusler compounds by Brillouin light scattering spectroscopy: application to CoMnSi
- Transverse dynamical magnetic susceptibilities from regular static density functional theory: Evaluation of damping and g-shifts of spin-excitations
- Evolution of ferromagnetic and spin-wave resonances with crystalline order in thin films of full-Heusler alloy Co2MnSi
- Effect of the double-counting functional on the electronic and magnetic properties of half-metallic magnets using the GGA+U method
- Brillouin light scattering study of CoCrFeAl and CoFeAl Heusler compounds
Cited by in corpus (8)
- Temperature-dependent Gilbert damping of Co2FeAl thin films with different degree of atomic order
- Non-local Gilbert damping tensor within the torque-torque correlation model
- Spin pumping and spin torque in interfacial tailored Co2FeAl/\b{eta}-Ta layers
- Half-metallicity and magnetism in the CoMnAl/CoMnVAl heterostructure
- First-principles study of exchange stiffness constant of half-metallic Heusler alloys Co2MnZ (Z= Si, Al) at finite temperatures: Spin fluctuation-induced effective half metallicity
- Regularities and features in the behavior of electrical and magnetic properties of CoFeZ (Z = Al, Si, Ga, Ge, Sn, Sb) half-metallic ferromagnetic Heusler alloys
- First-principles study of magnetic and spin-dependent transport properties of Mn2VZ (Z = Al, Ga) with negative spin polarization using a disordered local moment approach at finite temperatures
- Local magnetic structure in fully and partially ordered VAl Heusler alloys (=Cr, Mn, Fe, Co, Ni)