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Ferromagnetic solids acquire nontrivial magnetic and caloric properties when the temperature of the structural phase transition approaches the Curie point. Deciphering magneto-structural transitions, i.e. determining their characteristic…

Using fully self-consistent thermal broken-symmetry GW we construct effective magnetic Heisenberg Hamiltonians for a series of transition metal oxides (NiO, CoO, FeO, MnO), capturing a rigorous but condensed description of the magnetic…

材料科学 · 物理学 2023-03-22 Pavel Pokhilko , Dominika Zgid

Among the 3d transition metal ions doped polar Ni3TeO6, Mn-doped Ni3TeO6 has stimulated great interest due to its high magnetic ordering temperature and complex magnetic phases, but the mechanism of magnetoelectric (ME) coupling is far from…

The Heisenberg ferromagnet (uniaxially anisotropic along z-direction), in the presence of time dependent (but uniform over space) magnetic field, is studied by Monte Carlo simulation. The time dependent magnetic field was taken as…

统计力学 · 物理学 2011-05-02 Muktish Acharyya

We report that in YBa2Cu3Oy and La2-xSrxCuO4 there is a spatially inhomogeneous response to magnetic field for temperatures T extending well above the bulk superconducting transition temperature Tc. An inhomogeneous magnetic response is…

We report on a hierarchy of temperatures Tc < Tgap < Tmet in superconducting Rb1-xFe2-ySe2 observed by THz spectroscopy. Above Tmet = 90 K the material reveals semiconducting characteristics. Below Tmet a coherent metallic THz response…

超导电性 · 物理学 2014-03-05 Zhe Wang , M. Schmidt , J. Fischer , V. Tsurkan , M. Greger , D. Vollhardt , A. Loidl , J. Deisenhofer

We cast the relation between the chemical composition of a solid-state material and its superconducting critical temperature (Tc) as a statistical learning problem with reduced complexity. Training of query-aware similarity-based ridge…

超导电性 · 物理学 2024-11-11 Siwoo Lee , Jason Hattrick-Simpers , Young-June Kim , O. Anatole von Lilienfeld

Based on ab-initio calculated parameters, we apply a theoretical model on the iron-based BaFe2As2 superconductor that takes into account dramatic enhancements of the electron-phonon coupling of soft transverse phonons in the FeAs layers and…

超导电性 · 物理学 2019-06-14 Chi Ho Wong , Rolf Lortz

The non-stoichiometric Fe$_2$P-type (FeMnP$_{0.5}$Si$_{0.5}$)$_{1-x}$(FeV)$_{x}$ alloys ( $x=0, 0.01$, $0.02$, and $0.03$) have been investigated as potential candidates for magnetic refrigeration near room temperature. The magnetic…

The Y2SiO5 (YSO) crystal is a dielectric material with biaxial anisotropy with known values of refractive index at optical frequencies. It is a well-known rare-earth (RE) host material for optical research and more recently has shown…

材料科学 · 物理学 2015-06-11 N. C. Carvalho , J-M. Le Floch , J. Krupka , M. E. Tobar

We report on a 59Co NMR investigation of the trigonal cobaltate Ca3Co2O6 carried out on a single crystal, providing precise determinations of the electric field gradient and chemical shift tensors, and of the internal magnetic fields at the…

强关联电子 · 物理学 2015-05-20 G. Allodi , R. De Renzi , S. Agrestini , C. Mazzoli , M. R. Lees

Spectra of transmission and reflection coefficients of single crystalline Y-type hexaferrite Ba_(2)Mg_(2)Fe_(12)O_(22) are measured at Terahertz and infrared frequencies, 3 - 4500 c--1, and at temperatures 10 to 300 K, for polarization E…

Markov Chain Monte Carlo (MCMC) underlies both statistical physics and combinatorial optimization, but mixes slowly near critical points and in rough landscapes. Parallel Tempering (PT) improves mixing by swapping replicas across…

机器学习 · 计算机科学 2025-09-30 Saleh Bunaiyan , Corentin Delacour , Shuvro Chowdhury , Kyle Lee , Kerem Y. Camsari

We study the temperature dependence of the resistivity as a function of magnetic field in superconducting transition (Tconset - TcR=0) region for different Bi2Sr2CaCu2O8+{\delta} superconducting samples being synthesized using sol-gel…

超导电性 · 物理学 2015-06-04 Devina Sharma , Ranjan Kumar , V. P. S. Awana

Abundant phenomena in CoCr2-xMnxO4 (x = 0 ~ 2) samples such as magnetic compensation, magnetostriction and exchange bias effect have been observed and investigated in this work. A structure transition from cubic to tetragonal symmetry has…

材料科学 · 物理学 2013-10-21 H. G. Zhang , W. H. Wang , E. K. Liu , X. D. Tang , G. J. Li , J. L. Chen , H. W. Zhang , G. H. Wu

Frustrated magnets are one class of fascinating materials that host many intriguing phases such as spin ice, spin liquid and complex long-range magnetic orderings at low temperatures. In this work we use first-principles calculations to…

材料科学 · 物理学 2019-08-07 Yue-Wen Fang , Ruihan Yang , Hanghui Chen

We unify the method of exchange perturbation theory for multicenter systems. For the case of exchange degeneracy in the total spin of the system we give a secular equation that is more compact and convenient for calculations than those…

强关联电子 · 物理学 2015-03-25 Elena V. Orlenko , Tatiana Latychevskaia

We have studied the thermodynamic properties of a multiferroic that couples ferromagnetic and ferroelectric order. Some of the results are independent of the form of the free energy. We calculate the temperature dependence of the electric,…

材料科学 · 物理学 2011-01-31 G. R. Boyd , P. Kumar , S. R. Phillpot

We searched for stable crystal structures of YFe$_{12}$ using a crystal structure prediction technique based on a genetic algorithm and first-principles calculations. We obtained two monoclinic $C2/m$ structures as metastable phases that…

材料科学 · 物理学 2020-10-21 Takahiro Ishikawa , Taro Fukazawa , Takashi Miyake

We have used the Monte Carlo (MC) simulation method with Metropolis algorithm to study the finite temperature phase transition properties of a binary alloy spherical nanoparticle with radius $r$ of the type $A_{p}B_{1-p}$. The system…

统计力学 · 物理学 2017-03-08 Z. D. Vatansever , E. Vatansever
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