Higher Derivative Fermionic Field Equation in the First Order Formalism

The generalized Dirac equation of the third order, describing particles with spin 1/2 and three mass states, is analyzed. We obtain the first order generalized Dirac equation in the 24-dimensional matrix form. The mass and spin projection operators are found which extract solutions of the wave equation corresponding to pure spin states of particles. The density of the electromagnetic current is obtained, and minimal and non-minimal (anomalous) electromagnetic interactions of fermions are considered by introducing three phenomenological parameters. The Hamiltonian form of the first order equation has been obtained.Comment: 16 pages, title changed, new section, appendixes, and references adde

Two-color interference stabilization of atoms

The effect of interference stabilization is shown to exist in a system of two atomic levels coupled by a strong two-color laser field, the two frequencies of which are close to a two-photon Raman-type resonance between the chosen levels, with open channels of one-photon ionization from both of them. We suggest an experiment, in which a rather significant (up to 90%) suppression of ionization can take place and which demonstrates explicitly the interference origin of stabilization. Specific calculations are made for H and He atoms and optimal parameters of a two-color field are found. The physics of the effect and its relation with such well-known phenomena as LICS and population trapping in a three-level system are discussed.Comment: the paper includes 1 TeX file and 16 picture

On calculating the Berry curvature of Bloch electrons using the KKR method

We propose and implement a particularly effective method for calculating the Berry curvature arising from adiabatic evolution of Bloch states in wave vector k space. The method exploits a unique feature of the Korringa-Kohn-Rostoker (KKR) approach to solve the Schr\"odinger or Dirac equations. Namely, it is based on the observation that in the KKR method k enters the calculation via the structure constants which depend only on the geometry of the lattice but not the crystal potential. For both the Abelian and non-Abelian Berry curvature we derive an analytic formula whose evaluation does not require any numerical differentiation with respect to k. We present explicit calculations for Al, Cu, Au, and Pt bulk crystals.Comment: 13 pages, 5 figure

Solutions of Podolsky's Electrodynamics Equation in the First-Order Formalism

The Podolsky generalized electrodynamics with higher derivatives is formulated in the first-order formalism. The first-order relativistic wave equation in the 20-dimensional matrix form is derived. We prove that the matrices of the equation obey the Petiau-Duffin-Kemmer algebra. The Hermitianizing matrix and Lagrangian in the first-order formalism are given. The projection operators extracting solutions of field equations for states with definite energy-momentum and spin projections are obtained, and we find the density matrix for the massive state. The $13\times 13$-matrix Schrodinger form of the equation is derived, and the Hamiltonian is obtained. Projection operators extracting the physical eigenvalues of the Hamiltonian are found.Comment: 17 pages, minor corrections, published versio

The Effective Fragment Molecular Orbital Method for Fragments Connected by Covalent Bonds

We extend the effective fragment molecular orbital method (EFMO) into treating fragments connected by covalent bonds. The accuracy of EFMO is compared to FMO and conventional ab initio electronic structure methods for polypeptides including proteins. Errors in energy for RHF and MP2 are within 2 kcal/mol for neutral polypeptides and 6 kcal/mol for charged polypeptides similar to FMO but obtained two to five times faster. For proteins, the errors are also within a few kcal/mol of the FMO results. We developed both the RHF and MP2 gradient for EFMO. Compared to ab initio, the EFMO optimized structures had an RMSD of 0.40 and 0.44 {\AA} for RHF and MP2, respectively.Comment: Revised manuscrip

A proposal of a UCN experiment to check an earthquake waves model

Elastic waves with transverse polarization inside incidence plane can create longitudinal surface wave (LSW) after reflection from a free surface. At a critical incidence angle this LSW accumulates energy density, which can be orders of magnitude higher than energy density of the incident transverse wave. A specially arranged vessel for storage of ultracold neutrons (UCN) can be used to verify this effect.Comment: 8 pages 3 figures added a paragraph on vibrations along surface at critical angl