Related papers: Electron correlation in C_(4N+2) carbon rings: aro…
We study the structural and electronic properties of phase III of solid hydrogen using accurate many-electron theories and compare to state-of-the-art experimental findings. The atomic structures of phase III modelled by C2/c-24 crystals…
The electronic properties of quarter-filled organic materials showing spin-Peierls transition are investigated theoretically. By studying the one-dimensional extended Peierls-Hubbard model analytically as well as numerically, we find that…
We present a combined theoretical and experimental study of two quaternary Heusler alloys CoFeCrGe (CFCG) and CoMnCrAl (CMCA), promising candidates for spintronics applications. Magnetization measurement shows the saturation magnetization…
We investigate the violation of the first Hund's rule in 4$d$ and 5$d$ transition metal oxides that form solids of dimers. Bonding states within these dimers reduce the magnetization of such materials. We parametrize the dimer formation…
The pair correlation functions for a bilayer system of classical electrons has been calculated through a two-component HNC formalism. The results show changes in the structure of the correlation functions as the interlayer distance is…
A simple model for electron-vibron interactions on charged buckminsterfullerene C$_{60}^{n-}$, $n=1,\ldots 5$, is solved both at weak and strong couplings. We consider a single $H_g$ vibrational multiplet interacting with $t_{1u}$…
We present an analysis of the pairing resonances observed in photo-double-ionization studies of CnHm aromatic molecules with multiple benzene-like rings. The analysis, which is based on the Coulomb pairing model, is applied to naphthalene,…
Understanding the behavior of 4$f$ electrons in materials containing rare earth elements is one of the fundamental questions within condensed matter physics. In this work the electronic properties of isostructural CeCN$_5$ and TbCN$_5$,…
With the use of the band structure calculations we demonstrate that previously reported [Nat. Materials {\bf 3}, 48 (2004)] experimental crystal and magnetic structures for NaMn$_7$O$_{12}$ are inconsistent with each other. The optimization…
Low temperature scanning tunneling spectroscopy of HfNiSn shows a V^m(m < 1) zero bias anomaly around the Fermi level. This local density of states with a fractional power law shape is well known to be a consequence of electronic…
Effects of the electron-electron interaction on tunneling into a metal in ultra-high magnetic field (ultra-quantum limit) are studied. The range of the interaction is found to have a decisive effect both on the nature of the field-induced…
The Jahn-Teller effect in the charge-ordered (CO) state for La1-xCaxMnO3 (0.5<x<0.87) was studied by measuring the low-temperature powder x-ray diffraction, internal friction, and shear modulus. We find that the electron-lattice interaction…
We investigate the low-temperature magnetic and quantum properties of hexanuclear Fe$^ {3+}_6$ complexes under an external magnetic field. We primarily study the impact of competing exchange interactions and their asymmetries induced by the…
We derive an effective Hamiltonian that takes into account the quantum nature of phonons and models cooperative Jahn-Teller effect in the adiabatic regime and at strong electron-phonon coupling in one dimension. Our approach involves…
We present an ab-initio and analytical study of the Jahn-Teller effect in two diluted magnetic semiconductors (DMS) with d4 impurities, namely Mn-doped GaN and Cr-doped ZnS. We show that only the combined treatment of Jahn-Teller distortion…
A well-known property of aromatic molecules is their highly anisotropic response to the presence of an external magnetic field: the component of their magnetic susceptibility parallel to the field is generally much larger than the remaining…
Ground state of the quantum Jahn-Teller model with broken rotational symmetry was investigated by the variational approach in two cases: a lattice and a local ones. Both cases differ by the way of accounting for the nonlinearity hidden in…
Interplay of nonlinear and quantum effects in the ground state of the E$\otimes (b_1+b_2)$ Jahn-Teller model was investigated by the {\it variational approach and exact numerical simulations}. They result in the recognition of (i)…
The Heusler alloys Fe2NiZ (Z=Al, Ga, Si and Ge) have been synthesized and investigated focusing on the phase stability and the magnetic properties. The experimental and theoretical results reveal the covalent bonding originated from p-d…
Neutron spectroscopic measurements of the magnetic excitations in PrO$_2$ reveal (1) sharp peaks characteristic of transitions between levels of the $4f^1$ configuration of Pr$^{4+}$ split by the cubic crystal field, and (2) broad bands of…