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We present an \emph{ab initio} study of the effect of macroscopic deformation on energetics of twelve alloying elements in bcc Fe under three specially designed strain modes. We find that there exists a universal linear relation of…

Materials Science · Physics 2011-08-16 Wei Liu , Wei-Lu Wang , Q. F. Fang , C. S. Liu , Qun-Ying Huang , Yi-Can Wu

We suggest here the method of the mapping of DFT calculations on the multiorbital model in a following way: the parameters of the formulated multiorbital model should be determined from the requirement that the self-consistent charge and…

Materials Science · Physics 2017-03-01 V. S. Zhandun , N. G. Zamkova , S. G. Ovchinnikov , I. S. Sandalov

The electronic and magnetic properties of the hexanuclear ferric wheel [LiFe6(OCH3)12-(dbm)6]PF6 have been studied with all-electron Hartree-Fock and full-potential density functional calculations. The best agreement for the magnetic…

Other Condensed Matter · Physics 2007-05-23 H. Nieber , K. Doll , G. Zwicknagl

Multiferroic BiFeO3 undergoes a transition from a distorted spiral phase to a G-type antiferromagnet above a critical field H_c that depends on the orientation m of the field. We show that H_c(m) has a maximum when oriented along a cubic…

Materials Science · Physics 2015-06-16 Randy S. Fishman

Individual nuclear spin states can have very long lifetimes and could be useful as qubits. Progress in this direction was achieved on MgO/Ag(001) via detection of the hyperfine interaction (HFI) of Fe, Ti and Cu adatoms using scanning…

Mesoscale and Nanoscale Physics · Physics 2022-07-20 Sufyan Shehada , Manuel dos Santos Dias , Muayad Abusaa , Samir Lounis

Heusler alloys that undergo martensitic transformation in ferromagnetic state are of increasing scientific and technological interest. These alloys show large magnetic field induced strains upon martensitic phase change thus making it a…

Materials Science · Physics 2009-11-13 P. A. Bhobe , K. R. Priolkar , P. R. Sarode

A comparative study of the non-equilibrium magnetic phenomena (magnetic blocking, memory, exchange bias and aging effect) has been presented for ferrimagnetic Co$_{1.75}$Fe$_{1.25}$O$_4$ (CFO) and its composite with non-magnetic BaTiO$_3$…

Materials Science · Physics 2021-05-19 R. N. Bhowmik , R. Ranganathan

We consider a magnetic impurity which interacts by hybridization with a system of strongly correlated conduction electrons. The latter are described by a Hubbard Hamiltonian. By means of a canconical transformation the charge degrees of…

Condensed Matter · Physics 2009-10-22 Tom Schork , Peter Fulde

We investigate the properties of magnetic supracolliodal polymers -- magnetic filaments (MFs) -- with super-paramagnetic monomers, with and without Van der Waals (VdW) attraction between them. We employ molecular dynamics (MD) simulations…

Soft Condensed Matter · Physics 2020-03-10 Deniz Mostarac , Ekaterina Novak , Pedro A. Sánchez , Sofia Kantorovich

The maximum coercivity that can be achieved for a given hard magnetic alloy is estimated by computing the energy barrier for the nucleation of a reversed domain in an idealized microstructure without any structural defects and without any…

We have employed the relativistic coupled cluster theory to calculate the magnetic dipole and electric quadrupole hyperfine constants for the ground and low lying excited states of singly ionized magnesium. Comparison with experimental and…

Atomic Physics · Physics 2007-05-23 Chiranjib Sur , Bijaya K. Sahoo , Rajat K Chaudhuri , B. P. Das , D. Mukherjee

An explanation is given for the observed magnetic-field dependence of the low-temperature specific heat coefficient of Yb(4)As(3). It is based on a recently developed model for that material which can explain the observed heavy-fermion…

Condensed Matter · Physics 2009-10-28 Burkhard Schmidt , Peter Thalmeier , Peter Fulde

In metals near a quantum critical point, the electrical resistance is thought to be determined by the lifetime of the carriers of current, rather than the scattering from defects. The observation of $T$-linear resistivity suggests that the…

Strongly Correlated Electrons · Physics 2017-05-16 I. M. Hayes , Nicholas P. Breznay , Toni Helm , Philip Moll , Mark Wartenbe , Ross D. McDonald , Arkady Shekhter , James G. Analytis

We report local probe investigations of the magnetic interaction between BiFeO3 films and a ferromagnetic Co0.9Fe0.1 layer. Within the constraints of intralayer exchange coupling in the Co0.9Fe0.1, the multiferroic imprint in the…

Materials Science · Physics 2013-05-01 M. Trassin , J. D. Clarkson , S. R. Bowden , Jian Liu , J. T. Heron , R. J. Paull , E. Arenholz , D. T. Pierce , J. Unguris

This paper reports NMR measurements of the magnetic dipole moments of two high-K isomers, the 37/2$^-$, 51.4 m, 2740 keV state in $^{\rm 177}$Hf and the 8$^-$, 5.5 h, 1142 keV state in $^{\rm 180}$Hf by the method of on-line nuclear…

The hyperfine structure (hfs) and the g factor of a bound electron are caused by external magnetic fields. For the hfs, the magnetic field is due to the nuclear spin. A uniform-in-space and constant-in-time magnetic field is used to probe…

Atomic Physics · Physics 2015-05-14 Vladimir A. Yerokhin , Ulrich D. Jentschura

It has long been known that two-dimensional metals with antiferromagnetic exchange interactions have a weak-coupling instability to the superconductivity of spin-singlet, d-wave electron pairs. We examine additional possible instabilities…

Superconductivity · Physics 2014-02-26 Jay Deep Sau , Subir Sachdev

The performance characteristics of magnetic nanoparticles towards application, e.g. in medicine, imaging, or as sensors, is directly determined by their magnetization relaxation and total magnetic moment. In the commonly assumed picture,…

Combining material informatics and high-throughput electronic structure calculations offers the possibility of a rapid characterization of complex magnetic materials. Here we demonstrate that datasets of electronic properties calculated at…

Materials Science · Physics 2017-06-07 Mario Žic , Thomas Archer , Stefano Sanvito

The fundamental assumptions of the adiabatic theory do not apply in presence of sharp field gradients as well as in presence of well developed magnetohydrodynamic turbulence. For this reason in such conditions the magnetic moment $\mu$ is…

Space Physics · Physics 2015-06-04 S. Dalena , A. Greco , A. F. Rappazzo , R. L. Mace , W. H. Matthaeus