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The electronic structure and magnetic properties of disordered Fe$_{x}$Pd$_{100-x}$ alloys $(50 < x < 85)$ are investigated in the framework of density functional theory using the full potential local orbital method (FPLO). Disorder is…

材料科学 · 物理学 2009-04-07 Ingo Opahle , Klaus Koepernik , Ulrike Nitzsche , Manuel Richter

Using Gaussian integral transform techniques borrowed from functional-integral field theory and the replica trick we derive a version of the coherent-potential approximation (CPA) suited for describing ($i$) the diffusive (hopping) motion…

无序系统与神经网络 · 物理学 2015-06-15 S. Köhler , G. Ruocco , W. Schirmacher

Magnetic properties of Fe, Co, and Ni at finite temperatures have been investigated on the basis of the first-principles dynamical CPA (Coherent Potential Approximation) combined with the LDA (Local Density Approximation) + $U$ Hamiltonian…

强关联电子 · 物理学 2015-05-27 Yoshiro Kakehashi , M. Atiqur R. Patoary

A coherent description of the anomalous Hall effect (AHE) is presented that is applicable to pure as well as disordered alloy systems by treating all sources of the AHE on equal footing. This is achieved by an implementation of the…

材料科学 · 物理学 2015-05-19 S. Lowitzer , D. Ködderitzsch , H. Ebert

The interplay between the Kondo effect and disorder is studied. This is done by applying a matrix coherent potential approximation (CPA) and treating the Kondo interaction on a mean-field level. The resulting equations are shown to agree…

强关联电子 · 物理学 2013-05-29 S. Burdin , P. Fulde

We apply the Coherent Potential Approximation (CPA) to a simple extended Hubbard model with a nearest and next nearest neighbour hopping for disordered superconductors with s-, d- and p-wave pairing. We show how the Van Hove singularities…

超导电性 · 物理学 2015-06-24 G. Litak

We present a theory for carrier induced ferromagnetism in diluted magnetic semi-conductor (DMS). Our approach treats on equal footing quantum fluctuations within the RPA approximation and disorder within CPA. This method allows for the…

强关联电子 · 物理学 2009-11-07 G. Bouzerar , T. P. Pareek

The magnetic properties of solids are typically analyzed in terms of Heisenberg models where the electronic structure is approximated by interacting localized spins. However, even in such models the evaluation of thermodynamic properties…

材料科学 · 物理学 2025-01-31 Varun Rajeev Pavizhakumari , Thorbjørn Skovhus , Thomas Olsen

A Coherent Potential Approximation is developed for s-wave and d-wave superconductivity in disordered systems. We show that the CPA formalism reproduces the standard pair-breaking formula, the self-consistent Born Approximation and the…

超导电性 · 物理学 2009-10-31 A. M. Martin , G. Litak , B. L. Gyorffy , J. F. Annett , K. I. Wysokinski

In this work, we report coherent perfect absorption (CPA) of anti-modes in an indirectly coupled magnon--polariton system. By examining both single and indirectly coupled cases, we experimentally distinguish the modal decay rate $\gamma$…

介观与纳米尺度物理 · 物理学 2026-03-13 Chenyang Lu , Jiguang Yao , Jiongjie Wang , Jiang Xiao , Can-Ming Hu

The off-diagonal disorder caused by random spin orientations in the paramagnetic (PM) state of the double exchange (DE) model is described by using the coherent-potential-approximation (CPA), which is combined with the variational…

强关联电子 · 物理学 2007-05-23 I. V. Solovyev

The electronic, magnetic and transport properties of Fe intercalated 2H-TaS$_2$ have been investigated by means of the Korringa-Kohn-Rostoker (KKR) method. The non-stoichiometry and disorder in the system has been accounted for using the…

介观与纳米尺度物理 · 物理学 2015-10-21 S. Mankovsky , K. Chadova , D. Ködderitzsch , W. Bensch , H. Ebert

By merging single-site typical medium theory with density functional theory we introduce a self-consistent framework for electronic structure calculations of materials with substitutional disorder which takes into account Anderson…

无序系统与神经网络 · 物理学 2020-01-31 A. Östlin , Y. Zhang , H. Terletska , F. Beiuseanu , V. Popescu , K. Byczuk , L. Vitos , M. Jarrell , D. Vollhardt , L. Chioncel

We present a computational scheme for total energy calculations of disordered alloys with strong electronic correlations. It employs the coherent potential approximation combined with the dynamical mean-field theory and allows one to study…

强关联电子 · 物理学 2015-10-02 A. S. Belozerov , A. I. Poteryaev , S. L. Skornyakov , V. I. Anisimov

Using Korringa-Kohn-Rostoker coherent-potential approximation in the atomic-sphere approximation (KKR-ASA CPA) method for taking into account the effects of disorder, Gaspari-Gyorffy formalism for calculating the electron-phonon coupling…

超导电性 · 物理学 2009-11-07 P. Jiji Thomas Joseph , Prabhakar P. Singh

Compositionally complex materials (CCMs) present a potential paradigm shift in the design of magnetic materials. These alloys exhibit long-range structural order coupled with limited or no chemical order. As a result, extreme local…

A method is proposed for investigating the spontaneous magnetization, the spontaneous volume magnetostriction, and their relationship in disordered face-centered-cubic Fe$_{0.72}$Pt$_{0.28}$ and Fe$_{0.65}$Ni$_{0.35}$ in the temperature…

材料科学 · 物理学 2014-03-19 F. Liot

The coherent potential approximation, CPA, is a useful tool to treat systems with disorder. Cluster theories have been proposed to go beyond the translation invariant single-site CPA approximation and include some short range correlations.…

凝聚态物理 · 物理学 2009-10-31 C. I. Ventura , R. A. Barrio , .

A comprehensive analysis of half-doped manganites is presented using Monte Carlo simulations applied to the double-exchange model with cooperative Jahn-Teller lattice distortions in two dimensions. A variety of novel results are reported:…

强关联电子 · 物理学 2009-11-10 H. Aliaga , D. Magnoux , A. Moreo , D. Poilblanc , S. Yunoki , E. Dagotto

A general method is proposed for calculating a fully k-dependent, continuous, and causal spectral function A(k,E) within the recently introduced nonlocal version of the coherent-potential approximation (NLCPA). The method involves the…

材料科学 · 物理学 2009-11-11 G. M. Batt , D. A. Rowlands