Classical Concepts in Quantum Programming

The rapid progress of computer technology has been accompanied by a corresponding evolution of software development, from hardwired components and binary machine code to high level programming languages, which allowed to master the increasing hardware complexity and fully exploit its potential. This paper investigates, how classical concepts like hardware abstraction, hierarchical programs, data types, memory management, flow of control and structured programming can be used in quantum computing. The experimental language QCL will be introduced as an example, how elements like irreversible functions, local variables and conditional branching, which have no direct quantum counterparts, can be implemented, and how non-classical features like the reversibility of unitary transformation or the non-observability of quantum states can be accounted for within the framework of a procedural programming language.Comment: 11 pages, 4 figures, software available from http://tph.tuwien.ac.at/~oemer/qcl.html, submitted for QS2002 proceeding

On the concepts of radial and angular kinetic energies

We consider a general central-field system in D dimensions and show that the division of the kinetic energy into radial and angular parts proceeds differently in the wavefunction picture and the Weyl-Wigner phase-space picture. Thus, the radial and angular kinetic energies are different quantities in the two pictures, containing different physical information, but the relation between them is well defined. We discuss this relation and illustrate its nature by examples referring to a free particle and to a ground-state hydrogen atom.Comment: 10 pages, 2 figures, accepted by Phys. Rev.

Nonflammable, antistatic, and heat-sealable film

Antistatic, heat-sealable, nonflammable films prepared from polyvinylidene fluoride and polyvinylidene chloride resin

Surgery and the Spectrum of the Dirac Operator

We show that for generic Riemannian metrics on a simply-connected closed spin manifold of dimension at least 5 the dimension of the space of harmonic spinors is no larger than it must be by the index theorem. The same result holds for periodic fundamental groups of odd order. The proof is based on a surgery theorem for the Dirac spectrum which says that if one performs surgery of codimension at least 3 on a closed Riemannian spin manifold, then the Dirac spectrum changes arbitrarily little provided the metric on the manifold after surgery is chosen properly.Comment: 23 pages, 4 figures, to appear in J. Reine Angew. Mat

Segregation, precipitation, and \alpha-\alpha' phase separation in Fe-Cr alloys: a multi-scale modelling approach

Segregation, precipitation, and phase separation in Fe-Cr systems is investigated. Monte Carlo simulations using semiempirical interatomic potential, first-principles total energy calculations, and experimental spectroscopy are used. In order to obtain a general picture of the relation of the atomic interactions and properties of Fe-Cr alloys in bulk, surface, and interface regions several complementary methods has to be used. Using Exact Muffin-Tin Orbitals method the effective chemical potential as a function of Cr content (0-15 at.% Cr) is calculated for a surface, second atomic layer and bulk. At ~10 at.% Cr in the alloy the reversal of the driving force of a Cr atom to occupy either bulk or surface sites is obtained. The Cr containing surfaces are expected when the Cr content exceeds ~10 at.%. The second atomic layer forms about 0.3 eV barrier for the migration of Cr atoms between bulk and surface atomic layer. To get information on Fe-Cr in larger scales we use semiempirical methods. Using combined Monte Carlo molecular dynamics simulations, based on semiempirical potential, the precipitation of Cr into isolated pockets in bulk Fe-Cr and the upper limit of the solubility of Cr into Fe layers in Fe/Cr layer system is studied. The theoretical predictions are tested using spectroscopic measurements. Hard X-ray photoelectron spectroscopy and Auger electron spectroscopy investigations were carried out to explore Cr segregation and precipitation in Fe/Cr double layer and Fe_0.95Cr_0.05 and Fe_0.85Cr_0.15 alloys. Initial oxidation of Fe-Cr was investigated experimentally at 10^-8 Torr pressure of the spectrometers showing intense Cr_2O_3 signal. Cr segregation and the formation of Cr rich precipitates were traced by analysing the experimental spectral intensities with respect to annealing time, Cr content, and kinetic energy of the exited electron.Comment: 16 pages, 14 figures, 52 reference

Statistical properties of Klauder-Perelomov coherent states for the Morse potential

We present in this paper a realistic construction of the coherent states for the Morse potential using the Klauder-Perelomov approach . We discuss the statistical properties of these states, by deducing the Q- and P-distribution functions. The thermal expectations for the quantum canonical ideal gas of the Morse oscillators are also calculated

Antiferromagnetic Dimers of Ni(II) in the S=1 Spin-Ladder Na_2Ni_2(C_2O_4)_3(H_2O)_2

We report the synthesis, crystal structure and magnetic properties of the S=1 2-leg spin-ladder compound Na_2Ni_2(C_2O_4)_3(H_2O)_2. The magnetic properties were examined by magnetic susceptibility and pulsed high field magnetization measurements. The magnetic excitations have been measured in high field high frequency ESR. Although the Ni(II) ions form structurally a 2-leg ladder, an isolated dimer model consistently describes the observations very well. The analysis of the temperature dependent magnetization data leads to a magnetic exchange constant of J=43 K along the rungs of the ladder and an average value of the g-factor of 2.25. From the ESR measurements, we determined the single ion anisotropy to D=11.5 K. The validity of the isolated dimer model is supported by Quantum Monte Carlo calculations, performed for several ratios of interdimer and intradimer magnetic exchange and taking into account the experimentally determined single ion anisotropy. The results can be understood in terms of the different coordination and superexchange angles of the oxalate ligands along the rungs and legs of the 2-leg spin ladder.Comment: 8 pages, 10 figure

Invertible Dirac operators and handle attachments on manifolds with boundary

For spin manifolds with boundary we consider Riemannian metrics which are product near the boundary and are such that the corresponding Dirac operator is invertible when half-infinite cylinders are attached at the boundary. The main result of this paper is that these properties of a metric can be preserved when the metric is extended over a handle of codimension at least two attached at the boundary. Applications of this result include the construction of non-isotopic metrics with invertible Dirac operator, and a concordance existence and classification theorem.Comment: Accepted for publication in Journal of Topology and Analysi

Metalanguage in L1 English-speaking 12-year-olds: which aspects of writing do they talk about?

Traditional psycholinguistic approaches to metalinguistic awareness in L1 learners elicit responses containing metalanguage that demonstrates metalinguistic awareness of pre-determined aspects of language knowledge. This paper, which takes a more ethnographic approach, demonstrates how pupils are able to engage their own focus of metalanguage when reflecting on their everyday learning activities involving written language. What is equally significant is what their metalanguage choices reveal about their understanding and application of written language concepts

Wigner Trajectory Characteristics in Phase Space and Field Theory

Exact characteristic trajectories are specified for the time-propagating Wigner phase-space distribution function. They are especially simple---indeed, classical---for the quantized simple harmonic oscillator, which serves as the underpinning of the field theoretic Wigner functional formulation introduced. Scalar field theory is thus reformulated in terms of distributions in field phase space. Applications to duality transformations in field theory are discussed.Comment: 9 pages, LaTex2