Geometry and quantum delocalization of interstitial oxygen in silicon

The problem of the geometry of interstitial oxygen in silicon is settled by proper consideration of the quantum delocalization of the oxygen atom around the bond-center position. The calculated infrared absorption spectrum accounts for the 517 and 1136 cm$^{-1}$ bands in their position, character, and isotope shifts. The asymmetric lineshape of the 517 cm$^{-1}$ peak is also well reproduced. A new, non-infrared-active, symmetric-stretching mode is found at 596 cm$^{-1}$. First-principles calculations are presented supporting the nontrivial quantum delocalization of the oxygen atom.Comment: uuencoded, compressed postscript file for the whole. 4 pages (figures included), accepted in PR

Low-energy quantum dynamics of atoms at defects. Interstitial oxygen in silicon

The problem of the low-energy highly-anharmonic quantum dynamics of isolated impurities in solids is addressed by using path-integral Monte Carlo simulations. Interstitial oxygen in silicon is studied as a prototypical example showing such a behavior. The assignment of a "geometry" to the defect is discussed. Depending on the potential (or on the impurity mass), there is a "classical" regime, where the maximum probability-density for the oxygen nucleus is at the potential minimum. There is another regime, associated to highly anharmonic potentials, where this is not the case. Both regimes are separated by a sharp transition. Also, the decoupling of the many-nuclei problem into a one-body Hamiltonian to describe the low-energy dynamics is studied. The adiabatic potential obtained from the relaxation of all the other degrees of freedom at each value of the coordinate associated to the low-energy motion, gives the best approximation to the full many-nuclei problem.Comment: RevTeX, 6 pages plus 4 figures (all the figures were not accesible before

Static potential in baryon in the method of field correlators

The static three-quark potential in arbitrary configuration of quarks is calculated analytically. It is shown to be in a full agreement with the precise numerical simulations in lattice QCD. The results of the work have important application in nuclear physics, as they allow to perform accurate analytic calculations of spectra of the baryons.Comment: 12 pages, 4 eps figures, latex2e, to appear in Yad.Fi

Understanding light quanta: First quantization of the free electromagnetic field

The quantization of the electromagnetic field in vacuum is presented without reference to lagrangean quantum field theory. The equal time commutators of the fields are calculated from basic principles. A physical discussion of the commutators suggest that the electromagnetic fields are macroscopic emergent properties of more fundamental physical system: the photons

On the precision of chiral-dispersive calculations of ππ\pi\pi scattering

We calculate the combination $2a_0^{(0)}-5a_0^{(2)}$ (the Olsson sum rule) and the scattering lengths and effective ranges $a_1$, $a_2^{(I)}$ and $b_1$, $b_2^{(I)}$ dispersively (with the Froissart--Gribov representation) using, at low energy, the phase shifts for $\pi\pi$ scattering obtained by Colangelo, Gasser and Leutwyler (CGL) from the Roy equations and chiral perturbation theory, plus experiment and Regge behaviour at high energy, or directly, using the CGL parameters for $a$s and $b$s. We find mismatch, both among the CGL phases themselves and with the results obtained from the pion form factor. This reaches the level of several (2 to 5) standard deviations, and is essentially independent of the details of the intermediate energy region ($0.82\leq E\leq 1.42$ GeV) and, in some cases, of the high energy behaviour assumed. We discuss possible reasons for this mismatch, in particular in connection with an alternate set of phase shifts.Comment: Version to appear in Phys. Rev. D. Graphs and sum rule added. Plain TeX fil

Production of Heavy Quarks Close to Threshold

We calculate production by vector and axial currents of heavy quark pairs ($c\bar{c}$, $b\bar{b}$, $t\bar{t}$) close to threshold. We take into account strong interaction contributions (including radiative corrections and leading nonperturbative effects) by using the Fermi-Watson final state interaction theorem. We use the results obtained to compare with experiment for open production of $c\bar{c}$, $b\bar{b}$ near threshold, and to give a reliable estimate of the so-called ``threshold effects'' contribution to vector and axial correlators, for $t \bar{t}$, $i.e.$, the contribution of regions close to $4 m_t^2$ to $\Pi(t)$, for small values of $t$ ( 0 < t \lower2pt\hbox{\lesssim} M_Z^2 ).Comment: 36 pages, uses RevTeX, 7 postscript figures available upon reques

Calculation of αˉQ.E.D.\bar{\alpha}_{\rm Q.E.D.} on the Z

We perform a new, detailed calculation of the hadronic contributions to the running electromagnetic coupling, $\bar{\alpha}$, defined on the Z particle (91 GeV). We find for the hadronic contribution, including radiative corrections, 10^5\times \deltav_{\rm had.}\alpha(M_Z^2)= 2740\pm12, or, excluding the top quark contribution, 10^5\times \deltav_{\rm had.}\alpha^{(5)}(M_Z^2)= 2747\pm12. Adding the pure QED corrections we get a value for the running electromagnetic coupling of $$\bar{\alpha}_{\rm Q.E.D.}(M_Z^2)= {{1}\over{128.965\pm0.017}}.$$Comment: Version to appear in Phys. Rev. D. Plain TeX fil

Variational Worldline Approximation for the Relativistic Two-Body Bound State in a Scalar Model

We use the worldline representation of field theory together with a variational approximation to determine the lowest bound state in the scalar Wick-Cutkosky model where two equal-mass constituents interact via the exchange of mesons. Self-energy and vertex corrections are included approximately in a consistent way as well as crossed diagrams. Only vacuum-polarization effects of the heavy particles are neglected. In a path integral description of an appropriate current-current correlator an effective, retarded action is obtained by integrating out the meson field. As in the polaron problem we employ a quadratic trial action with variational functions to describe retardation and binding effects through multiple meson exchange.The variational equations for these functions are derived, discussed qualitatively and solved numerically. We compare our results with the ones from traditional approaches based on the Bethe-Salpeter equation and find an enhanced binding contrary to some claims in the literature. For weak coupling this is worked out analytically and compared with results from effective field theories. However, the well-known instability of the model, which usually is ignored, now appears at smaller coupling constants than in the one-body case and even when self-energy and vertex corrections are turned off. This induced instability is investigated analytically and the width of the bound state above the critical coupling is estimated.Comment: 62 pages, 7 figures, FBS style, published versio

Generalized Relativistic Meson Wave Function

We study the most general, relativistic, constituent $q{\overline q}$ meson wave function within a new covariant framework. We find that by including a tensor wave function component, a pure valence quark model is now capable of reproducing not only all static pion data ($f_\pi$, $\langle r_\pi^2 \rangle$) but also the distribution amplitude, form factor $(F_\pi(Q^2))$, and structure functions. Further, our generalized spin wave function provides a much better detailed description of meson properties than models using a simple relativistic extension of the $S=L=0$ nonrelativistic wave function.Comment: 17 pages, REXTeX 3.0 file, (uuencoded postscript files of 8 figures appended

Chiral Symmetry and Diffractive Neutral Pion Photo- and Electroproduction

We show that diffractive production of a single neutral pion in photon-induced reactions at high energy is dynamically suppressed due to the approximate chiral symmetry of QCD. These reactions have been proposed as a test of the odderon exchange mechanism. We show that the odderon contribution to the amplitude for such reactions vanishes exactly in the chiral limit. This result is obtained in a nonperturbative framework and by using PCAC relations between the amplitudes for neutral pion and axial vector current production.Comment: 22 pages, 7 figure