Related papers: Electronic correlations at the alpha-gamma structu…
Below the critical temperature $T_c\simeq 600 K$, an iso-structural transition, named $\gamma$-$\alpha$ transition,can be induced in Cerium by applying pressure. This transition is first-order, and is accompanied by a sizable volume…
Density functional calculations are performed to investigate the phase transition in FeRh alloy. The effective exchange coupling, the critical temperature of magnetic phase transition and the adiabatic spin wave spectrum have been obtained.…
Modern state-of-the-art techniques allow us to explore the magnetic and electronic structures of cuprates throughout the whole phase diagram, which defines the central questions on their emergent high temperature superconductivity. However,…
An understanding of the phase diagram of elemental plutonium (Pu) must include both the effects of the strong directional bonding and the high density of states of the Pu 5f electrons, as well as how that bonding weakens under the influence…
The Dirac oscillator in a homogenous magnetic field exhibits a chirality phase transition at a particular (critical) value of the magnetic field. Recently, this system has also been shown to be exactly solvable in the context of…
Magnetic properties of a polycrystalline alloy Ni$_{2.19}$Mn$_{0.81}$Ga, which undergoes a first-order magnetostructural phase transition from cubic paramagnetic to tetragonal ferromagnetic phase, are studied. Hysteretic behavior of…
We perform density functional calculations to investigate the structure of the inter-metallic alloy FeRh under epitaxial strain. Bulk FeRh exhibits a metamagnetic transition from a low-temperature antiferromagnetic (AFM) phase to a…
We investigate paramagnetic metal-insulator transitions in the infinite-dimensional ionic Hubbard model at finite temperatures. By means of the dynamical mean-field theory with an impurity solver of the continuous-time quantum Monte Carlo…
The stability of different phases of the three-dimensional non-relativistic electron gas is analyzed using stochastic methods. With decreasing density, we observe a {\it continuous} transition from the paramagnetic to the ferromagnetic…
The magnetic response of the charged anyon fluid at temperatures larger than the fermion energy gap is investigated in the self-consistent field approximation. In this temperature region a new phase, characterized by an inhomogeneous…
We apply the phase field crystal model to study the structure and energy of symmetric tilt grain boundaries of bcc iron in 3D. The parameters for the model are obtained by using a recently developed eight-order fitting scheme [A. Jaatinen…
The model of a strongly correlated system in which periodically spaced Anderson-Hubbard centers are introduced into narrow-band metal is considered. Besides the interactions between localized magnetic moments and strong on-site Coulomb…
We study ferromagnetic transition in three-dimensional double-exchange model. The influence of strong spin fluctuations on conduction electrons is described in coherent potential approximation. In the framework of thermodynamic approach we…
A variety of compounds, for example doped paraelectrics and polar metals, exhibit both ferroelectricity and correlated electronic phenomena such as low-density superconductivity and anomalous transport. Characterizing such properties is…
We discuss the interplay between anti-ferromagnetic order and polarization fluctuations in a magnetic quantum paraelectric. Using an action where anti-ferromagnetic order parameter couples to the polarization fluctuations and as well as…
Ultrafast laser excitation can induce fast increases of the electronic subsystem temperature. The subsequent electronic evolutions in terms of band structure and energy distribution can determine the change of several thermodynamic…
The variational and diffusion quantum Monte Carlo methods are used to calculate the correlation energy of the paramagnetic three-dimensional homogeneous electron gas at intermediate to high density. Ground state energies in finite cells are…
A theory of the magnetic field driven (semi-)metal-insulator phase transition is developed for planar systems with a low density of carriers and a linear (i.e., relativistic like) dispersion relation for low energy quasiparticles. The…
The simple cubic spin-1 Ising (BEG) model exhibits the ferromagnetic (F) - ferromagnetic (F) phase transition at low temperature region for the interval 1.40<d=D/J<1.48 at k=K/J=-0.5. The degree of the F-F phase transtion determines the…
In this work, results of {\it ab-initio} band structure calculations for $A_2BC$ Heusler compounds that have $A$ and $B$ sites occupied by transition metals and $C$ by a main group element are presented. This class of materials includes…