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The hyperfine structure of the long-lived $5D_{3/2}$ and $5D_{5/2}$ levels of Ba$^+$ ion is analyzed. A procedure for extracting relatively unexplored nuclear magnetic moments $\Omega$ is presented. The relevant electronic matrix elements…

Atomic Physics · Physics 2009-11-13 K. Beloy , A. Derevianko , V. A. Dzuba , G. T. Howell , B. B. Blinov , E. N. Fortson

The investigation of magnetic energy landscapes and the search for ground states of magnetic materials using ab initio methods like density functional theory (DFT) is a challenging task. Complex interactions, such as superexchange and…

Materials Science · Physics 2024-12-24 Jakob Baumsteiger , Lorenzo Celiberti , Patrick Rinke , Milica Todorović , Cesare Franchini

Magnetic refrigeration presents an energy-efficient and environmentally benign alternative to traditional vapour-compression cooling technologies. It relies on the magnetocaloric effect, in which the temperature of a magnetic material…

Materials Science · Physics 2025-12-23 Jayendran S , Abhishek K G , Suresh R , Helmer Fjellvåg , Ravindran P

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…

Statistical Mechanics · Physics 2017-03-08 Z. D. Vatansever , E. Vatansever

Magnetic 2D materials have achieved significantly consideration owing to their encouraging applications. A variation of these 2D materials by occurrence of defects, by the transition-metal doping or adsorption or by the surface…

Materials Science · Physics 2025-06-27 Zarah Khan , Saleem Ayaz Khan , Ayesha Zaheer , Syed Rizwan

The cluster multipole (CMP) expansion for magnetic structures provides a scheme to systematically generate candidate magnetic structures specifically including noncollinear magnetic configurations adapted to the crystal symmetry of a given…

Materials Science · Physics 2021-02-19 Marie-Therese Huebsch , Takuya Nomoto , Michi-To Suzuki , Ryotaro Arita

Molecular spintronics devices (MSDs) are highly promising candidates for enabling quantum computation and revolutionizing computer logic and memory. An advanced MSD will require the placement of magnetic molecules between the two…

Mesoscale and Nanoscale Physics · Physics 2019-12-04 Pawan Tyagi , Christopher D Angelo , Collin Baker

We have studied the hard magnetic properties of the low-temperature phase of MnBi with first principle calculations based on the density functional theory. The calculations have been carried out on two distinct unit cell configurations MnBi…

Materials Science · Physics 2015-08-14 Peter Toson , Ahmad Asali , Gregor A. Zickler , Josef Fidler

We present a novel algorithm that is based on a Bayesian Markov Chain Monte Carlo (MCMC) technique for performing robust profile analysis of a data cube from either single-dish or interferometric radio telescopes. It fits a set of models…

Astrophysics of Galaxies · Physics 2019-05-22 Se-Heon Oh , Lister Staveley-Smith , Bi-Qing For

We present a multi-scale computational approach that combines atomistic spin models with the cluster multipole (CMP) method. The CMP method enables a systematic and accurate generation of complex non-collinear magnetic structures using…

Materials Science · Physics 2025-03-06 Juba Bouaziz , Takuya Nomoto , Ryotaro Arita

The design and synthesis of targeted functional materials have been a long-term goal for material scientists. Although a universal design strategy is difficult to generate for all types of materials, however, it is still helpful for a…

Materials Science · Physics 2020-06-23 Xin Gui , Weiwei Xie

The accurate determination of magnetic phase transitions in electronic systems is an important task of solid state theory. While numerically exact results are readily available for model systems such as the half-filled 3D Hubbard model, the…

Strongly Correlated Electrons · Physics 2022-01-19 Sergei Iskakov , Emanuel Gull

Strong magnetic fields have a large impact on the dynamics of molecules. In addition to the changes of the electronic structure, the nuclei are exposed to the Lorentz force with the magnetic field being screened by the electrons. In this…

Chemical Physics · Physics 2021-07-28 Laurens D. M. Peters , Tanner Culpitt , Laurenz Monzel , Erik I. Tellgren , Trygve Helgaker

The magnetic properties of Mn-doped ZnO semi-conductor have been investigated using the Monte Carlo method within the Ising model. The temperature dependences of the spontaneous magnetization, specific heat and magnetic susceptibility have…

Materials Science · Physics 2015-05-28 L. B Drissi , A. Benyoussef , E. H Saidi , M. Bousmina

Hamiltonian parameter estimation is crucial in condensed matter physics, but time and cost consuming in terms of resources used. With advances in observation techniques, high-resolution images with more detailed information are obtained,…

Disordered Systems and Neural Networks · Physics 2019-11-15 Dingchen Wang , Songrui Wei , Anran Yuan , Fanghua Tian , Kaiyan Cao , Qizhong Zhao , Dezhen Xue , Sen Yang

We examine different models and methods for studying finite-temperature magnetic hysteresis in nanoparticles and ultrathin films. This includes micromagnetic results for the hysteresis of a single magnetic nanoparticle which is misaligned…

Materials Science · Physics 2007-05-23 M. A. Novotny , D. T. Robb , S. M. Stinnett , G. Brown , P. A. Rikvold

We present an experimental approach using magnetic force microscopy for measurements of the absolute value of the magnetic penetration depth $\lambda$ in superconductors. $\lambda$ is obtained in a simple and robust way without introducing…

Magnetic topological insulators and semi-metals have a variety of properties that make them attractive for applications including spintronics and quantum computation, but very few high-quality candidate materials are known. In this work, we…

Materials Science · Physics 2021-04-21 Kamal Choudhary , Kevin F. Garrity , Nirmal J. Ghimire , Naween Anand , Francesca Tavazza

Considering the growing interest in magnetic materials for unconventional computing, data storage, and sensor applications, there is active research not only on material synthesis but also characterisation of their properties. In addition…

Machine learning potentials have emerged as a powerful tool to extend the time and length scales of first principles-quality simulations. Still, most machine learning potentials cannot distinguish different electronic spin orientations and…

Computational Physics · Physics 2022-01-25 Marco Eckhoff , Jörg Behler