Related papers: Comments on 'Phonon and magnetic structure in {\de…
The deuteron form factors are calculated in the framework of the relativistic nucleon-meson dynamics, by means of the explicitly covariant light-front approach. The inflluence of the nucleon electromagnetic form factors is discussed. At…
In this work we review the formalism normally used in the literature about the effects of density-dependent magnetic fields on the properties of neutron and quark stars, expose some ambiguities that arise and propose a way to solve the…
I review recent results regarding the nucleon charge and magnetization densities as well as the shape of the nucleon. First, some phenomenolgical considerations that show that the shape of the proton is not round are discussed. Then model…
We present results of a density functional theory study of MnO in the wurtzite structure. Our motivation is provided by recent experiments reporting ferromagnetism in Mn-doped wurtzite structure ZnO. We find that wurtzite MnO a) is not…
In comparison to 3d or 4f metals, magnetism in actinides remains poorly understood due to experimental complications and the exotic behavior of the 5f states. In particular, plutonium metal is most especially vexing. Over the last five…
Electronic structure of V$_{15}$ magnetic molecules (K$_6$ [V$_{15}$ As$_6$ O$_{42}$ (H$_2$O)] \cdot 8H$_2$O)$ has been studied using LSDA+U band structure calculations, and measurements of X-ray photoelectron (valence band, core levels)…
The structural and magnetic properties of Fe octaethylporphyrin (OEP) molecules on Cu(001) have been investigated by means of density functional theory (DFT) methods and X-ray absorption spectroscopy. The molecules have been adsorbed on the…
In the framework of density functional theory a new formulation of electronegativity that recovers the Mulliken definition is proposed and its reliability is checked by computing electronegativity values for a large number of elements. It…
In this paper, we propose an efficient implementation of combining Dynamical Mean field theory (DMFT) with electronic structure calculation based on the local density approximation (LDA). The pseudo-potential-plane-wave method is used in…
We derive the exact solution for the optical conductivity $\sigma(\omega)$ of one hole in the Holstein-t-J model in the framework of dynamical mean-field theory (DMFT). We investigate the magnetic and phonon features associated with polaron…
Phonon properties of realistic materials are routinely calculated within the Density Functional Perturbation Theory\,(DFPT). This is a semi--classical approach where the atoms are assumed to oscillate along classical trajectories immersed…
A synopsis exemplifying the employment of Dyson-Schwinger equations in the calculation and explanation of hadron electromagnetic form factors and related phenomena. In particular the contribution: presents the pion form factor computed…
Density functional theory (DFT) provides a theoretical framework for efficient and fairly accurate calculations of the electronic structure of molecules and crystals. The main features of density functional theory are described and DFT…
We develop a theoretical and computational framework to study polarons in semiconductors and insulators from first principles. Our approach provides the formation energy, excitation energy, and wavefunction of both electron and hole…
Ferromagnetic \nmg has unique magnetoelastic properties. These are investigated by detailed computational studies of the phonon dispersion curves for the non-modulated cubic \Ltw and tetragonal structures. For the \Ltw\ structure, a…
We present a consistent calculation of the structure functions within a light-front constituent quark model of the nucleon. Relativistic effects and the relevance of the covariance constraints are analyzed for polarized parton…
A density-functional theory is developed based on the Maxwell--Schr\"odinger equation with an internal magnetic field in addition to the external electromagnetic potentials. The basic variables of this theory are the electron density and…
I discuss recent work on nucleon form factors, magnetic strangeness in the nucleon and the isovector nucleon-delta transition based on the broken chiral symmetry of QCD, utilizing recent theoretical developments in ChPT.
We report progress on nuclear structure functions, especially on their nuclear modifications and a new tensor structure function for the deuteron. To understand nuclear structure functions is an important step toward describing nuclei and…
We present a detailed analysis of the results of our numerical study of the crystal and electronic structure of the room temperature organometallic ferrimagnet of general composition V(TCNE)$_{x}$ with $% x\approx 2$. The results of the…