Related papers: SrCu$_2$(BO$_3$)$_2$ under pressure: a first-princ…
Density functional theory (DFT) calculations are used to study the magnetic and ferroelectric properties of Sr$_{1-x}$Ba$_{x}$MnO$_3$, with focus on $x=0.5$, under isotropic volume expansion/compression and biaxial strain. Our results…
Using density matrix renormalization group (DMRG) and perturbative continuous unitary transformations (PCUTs), we study the magnetization process in a magnetic field for all coupling strengths of a quasi-1D version of the 2D…
We study magnetic properties of the $S=1/2$ Ising-like XXZ model on the Shastry-Sutherland lattices with long-range interactions, using the quantum Monte Carlo method. This model shows magnetization plateau phases at one-half and one-third…
A thorough study of EuZn$_2$P$_2$ single crystals, which were grown from Sn flux, was performed using both bulk (heat capacity, ac susceptibility, dc magnetization, electrical resistivitivity, magnetoresistance) and microscopic (M\"ossbauer…
We have investigated the magnetic-field- and pressure-induced structural and magnetic phases of the triple-layer ruthenate - Sr$_{4}$Ru$_{3}$O$_{10}$. Magnetic-field-induced changes in the phonon spectra reveal dramatic spin-reorientation…
We have investigated the magnetic transition and magnetic structure of triple-layered ruthenate Sr4Ru3O10 directly using neutron scattering techniques. Only one ferromagnetic phase is observed, and previously proposed antiferromagnetic…
We have studied spin excitation spectra in the Shastry-Sutherland model compound SrCu$_2$(BO$_3$)$_2$ in magnetic fields using far-infrared Fourier spectroscopy. The transitions from the ground singlet state to the triplet state at 24…
We investigate the pressure and temperature dependence of the lattice dynamics of the underdoped, stoichiometric, high temperature superconductor YBa2Cu4O8 by means of Raman spectroscopy and ab initio calculations. This system undergoes a…
We have employed first principles calculations to study the electronic structure and magnetic properties of the low-dimensional phosphates, Ba2Cu(PO4)2 and Sr2Cu(PO4)2. Using the self-consistent tight-binding lin- earized muffin-tin orbital…
Using Density Functional Theory (DFT) calculations and Monte-Carlo (MC) simulations, we investigate the recently reported magnetic transition in B2 Al-Cr-Co alloys. The Cr sublattice is alloyed with different amounts of Co in the…
A model of two-species bosons moving on the sites of a lattice is studied at nonzero temperature, focusing on magnetic order and superfluid-insulator transitions. Firstly, Landau theory is used to find the general structure of the phase…
Alkaline-earth metal oxides, in particular MgO and CaO dominate Earths lower mantle, therefore, exploring high pressure behavior of this class of compounds is of significant geophysical research interest. Among all these compounds, BaO…
We investigate classical Heisenberg spins on the Shastry-Sutherland lattice and under an external magnetic field. A detailed study is carried out both analytically and numerically by means of classical Monte-Carlo simulations. Magnetization…
RuO$_2$ has been regarded as a prototypical candidate for metallic altermagnet, offering a potential platform for high-speed and high-efficiency spintronics. However, the magnetic ground state of RuO$_2$ remains a topic of active debate due…
This paper presents structural, detailed magnetic, and exchange bias studies in polycrystalline Ba$_{2}$ScRuO$_{6}$ synthesized at ambient pressure. In contrast to its strontium analogue, this material crystallizes in a 6L hexagonal…
Using first-principles calculations, the elastic constants, thermodynamic property and structural phase transition of rhenium diboride under pressure are investigated by means of the pseudopotential plane-waves method, as well as the effect…
Magnetic and crystallographic transitions in the Cairo pentagonal magnet Bi2Fe4O9 are investigated by means of infrared synchrotron-based spectroscopy as a function of temperature (20 - 300 K) and pressure (0 - 15.5 GPa). One of the phonon…
Synchrotron x-ray diffraction experiments were performed on BaFe$_2$As$_2$ and Sr(Fe$_{1-x}$Co$_{x}$)$_2$As$_2$ single crystals as a function of temperature and applied magnetic field along the tetragonal $[1 \bar{1} 0]$ direction,…
VO2 is renowned for its electric transition from an insulating monoclinic (M1) phase characterized by V-V dimerized structures, to a metallic rutile (R) phase above 340 Kelvin. This transition is accompanied by a magnetic change: the M1…
Plutonium dioxide is of high technological importance in nuclear fuel cycle and is particularly crucial in long-term storage of Pu-based radioactive waste. Using first-principles density-functional theory, in this paper we systematically…