Related papers: Analysis of Charge-spin-orbital Fluctuations by Ab…
In the one-loop approximation for the periodic Anderson model the contributions of spin and charge fluctuations to the renormalization of the antiferromagnetic order parameter are calculated. It is shown that taking into account the…
Motivated by recent experiments on vanadium spinels, $A$V$_2$O$_4$, that show an increasing degree of electronic delocalization for smaller cation sizes, we study the evolution of orbital ordering (OO) between the strong and…
Towards understanding the multi-orbital quantum antiferromagnetism in iron pnictides, effective spin couplings and spin fluctuation induced quantum corrections to sublattice magnetization are obtained in the $(\pi,0)$ AF state of a…
Spin fluctuations were studied over a wide momentum ($\hbar Q$) and energy ($E$) space in the frustrated $d$-electron heavy-fermion metal LiV$_2$O$_4$ by time-of-flight inelastic neutron scattering. We observed the overall $Q$$-$$E$…
The superconducting order parameter of strontium ruthenate is the center of a lasting puzzle calling for theoretical studies that include the seldom-considered effects of spin-orbit coupling and the frequency-dependence of the order…
Molecular Dynamics (MD) simulations of a strongly coupled binary ionic mixture have revealed the appearance of sharp minima in the species resolved dynamical density fluctuation spectra. This phenomenon is reminiscent of the well-known Fano…
Evolution of composite spin-orbital order and coupled spin-orbital excitations is studied in a variety of $d^4$ systems with $n$=$4$ electrons in the $t_{2g}$ orbital sector using the generalised self-consistent + fluctuations approach for…
The dynamical spin susceptibility is studied in the magnetically-disordered phase of heavy-Fermion systems near the antiferromagnetic quantum phase transition. In the framework of the $S=1/2$ Kondo lattice model, we introduce a perturbative…
Based on the refined crystal structure comprised of columns of 3*4 planar blocks of NbO6 octahedra and first principles electronic structure methods, we find that orthorhombic (o)-Nb$_{12}$O$_{29}$ introduces a new class of transition metal…
We perform a comprehensive theoretical study of the pressure-induced evolution of the electronic structure, magnetic state, and phase stability of the late transition metal monoxides MnO, FeO, CoO, and NiO using a fully charge…
This thesis deals with the Hubbard model as prototypical model to describe the physics of electrons in the two-dimensional copper-oxide planes of high-$T_c$ cuprates. To get approximate solutions, we employ functional renormalization group…
Isotopic fluctuations in fragment formation are investigated in a quasi-analytical description of the spinodal decomposition scenario. By exploiting the fluctuation-dissipation relations the covariance matrix of density fluctuations is…
Based on the {\it ab-initio} band structure for Na$_x$CoO$_2$ we derive the single-electron energies and the effective tight-binding description for the $t_{2g}$ bands using projection procedure. Due to the presence of the…
To understand the recently established unique magnetic and superconducting phase diagram of LaFeAsO$_{1-x}$H$_x$, we analyze the realistic multiorbital tight-binding model for $x=0 \sim 0.4$ beyond the rigid band approximation. Both the…
A characteristic feature of the Gaussian approximation in the functional-integral approach to the spin-fluctuation theory is the jump phase transition to the paramagnetic state. We eliminate the jump and obtain a continuous second-order…
We discuss phenomena arising from the combined influence of electron correlation and spin-orbit coupling, with an emphasis on emergent quantum phases and transitions in heavy transition metal compounds with 4d and 5d elements. A common…
Superconductivity and polar charge fluctuation are studied in an organic conductor with the dimer-molecule degree of freedom. The extended Hubbard models, where the intra-dimer electronic structure and the inter-dimer Coulomb interactions…
Systems with strong electronic Coulomb correlations often display rich phase diagrams exhibiting different ordered phases involving spin, charge, or orbital degrees of freedom. The theoretical description of the interplay of the…
We present a systematic study of quantum fluctuations in the C-type and A-type antiferromagnetic (AF) phases in cubic lattices and in bilayer systems. Using the linear spin-wave theory, we show that the spin stiffness and the quantum…
A combination of density functional theory in its local density approximation (LDA) with k- and $\omega $ dependent self-energy found from fluctuational-exchange-type random phase approximation (FLEX-RPA) is utilized here to study…