A simple and surprisingly accurate approach to the chemical bond obtained from dimensional scaling

We present a new dimensional scaling transformation of the Schrodinger equation for the two electron bond. This yields, for the first time, a good description of the two electron bond via D-scaling. There also emerges, in the large-D limit, an intuitively appealing semiclassical picture, akin to a molecular model proposed by Niels Bohr in 1913. In this limit, the electrons are confined to specific orbits in the scaled space, yet the uncertainty principle is maintained because the scaling leaves invariant the position-momentum commutator. A first-order perturbation correction, proportional to 1/D, substantially improves the agreement with the exact ground state potential energy curve. The present treatment is very simple mathematically, yet provides a strikingly accurate description of the potential energy curves for the lowest singlet, triplet and excited states of H_2. We find the modified D-scaling method also gives good results for other molecules. It can be combined advantageously with Hartree-Fock and other conventional methods.Comment: 4 pages, 5 figures, to appear in Phys. Rev. Letter

Diffusive Atomistic Dynamics of Edge Dislocations in Two Dimensions

The fundamental dislocation processes of glide, climb, and annihilation are studied on diffusive time scales within the framework of a continuum field theory, the Phase Field Crystals (PFC) model. Glide and climb are examined for single edge dislocations subjected to shear and compressive strain, respectively, in a two dimensional hexagonal lattice. It is shown that the natural features of these processes are reproduced without any explicit consideration of elasticity theory or ad hoc construction of microscopic Peierls potentials. Particular attention is paid to the Peierls barrier for dislocation glide/climb and the ensuing dynamic behavior as functions of strain rate, temperature, and dislocation density. It is shown that the dynamics are accurately described by simple viscous motion equations for an overdamped point mass, where the dislocation mobility is the only adjustable parameter. The critical distance for the annihilation of two edge dislocations as a function of separation angle is also presented.Comment: 13 pages with 17 figures, submitted to Physical Review

Gravitational wave energy spectrum of a parabolic encounter

We derive an analytic expression for the energy spectrum of gravitational waves from a parabolic Keplerian binary by taking the limit of the Peters and Matthews spectrum for eccentric orbits. This demonstrates that the location of the peak of the energy spectrum depends primarily on the orbital periapse rather than the eccentricity. We compare this weak-field result to strong-field calculations and find it is reasonably accurate (~10%) provided that the azimuthal and radial orbital frequencies do not differ by more than ~10%. For equatorial orbits in the Kerr spacetime, this corresponds to periapse radii of rp > 20M. These results can be used to model radiation bursts from compact objects on highly eccentric orbits about massive black holes in the local Universe, which could be detected by LISA.Comment: 5 pages, 3 figures. Minor changes to match published version; figure 1 corrected; references adde

The Schwinger SU(3) construction - I: Multiplicity problem and relation to induced representations

The Schwinger oscillator operator representation of SU(3) is analysed with particular reference to the problem of multiplicity of irreducible representations. It is shown that with the use of an $Sp(2,R)$ unitary representation commuting with the SU(3) representation, the infinity of occurrences of each SU(3) irreducible representation can be handled in complete detail. A natural `generating representation' for SU(3), containing each irreducible representation exactly once, is identified within a subspace of the Schwinger construction; and this is shown to be equivalent to an induced representation of SU(3).Comment: Latex, 25 page

Topological properties of Berry's phase

By using a second quantized formulation of level crossing, which does not assume adiabatic approximation, a convenient formula for geometric terms including off-diagonal terms is derived. The analysis of geometric phases is reduced to a simple diagonalization of the Hamiltonian in the present formulation. If one diagonalizes the geometric terms in the infinitesimal neighborhood of level crossing, the geometric phases become trivial for any finite time interval $T$. The topological interpretation of Berry's phase such as the topological proof of phase-change rule thus fails in the practical Born-Oppenheimer approximation, where a large but finite ratio of two time scales is involved.Comment: 9 pages. A new reference was added, and the abstract and the presentation in the body of the paper have been expanded and made more precis

Abdominal functional electrical stimulation to assist ventilator weaning in acute tetraplegia: a cohort study

Background Severe impairment of the major respiratory muscles resulting from tetraplegia reduces respiratory function, causing many people with tetraplegia to require mechanical ventilation during the acute stage of injury. Abdominal Functional Electrical Stimulation (AFES) can improve respiratory function in non-ventilated patients with sub-acute and chronic tetraplegia. The aim of this study was to investigate the clinical feasibility of using an AFES training program to improve respiratory function and assist ventilator weaning in acute tetraplegia.<p></p> Methods AFES was applied for between 20 and 40 minutes per day, five times per week on four alternate weeks, with 10 acute ventilator dependent tetraplegic participants. Each participant was matched retrospectively with a ventilator dependent tetraplegic control, based on injury level, age and sex. Tidal Volume (VT) and Vital Capacity (VC) were measured weekly, with weaning progress compared to the controls.<p></p> Results Compliance to training sessions was 96.7%. Stimulated VT was significantly greater than unstimulated VT. VT and VC increased throughout the study, with mean VC increasing significantly (VT: 6.2 mL/kg to 7.8 mL/kg VC: 12.6 mL/kg to 18.7 mL/kg). Intervention participants weaned from mechanical ventilation on average 11 (sd: ± 23) days faster than their matched controls.<p></p> Conclusion The results of this study indicate that AFES is a clinically feasible technique for acute ventilator dependent tetraplegic patients and that this intervention may improve respiratory function and enable faster weaning from mechanical ventilation.<p></p&gt

Weyl formulas for annular ray-splitting billiards

We consider the distribution of eigenvalues for the wave equation in annular (electromagnetic or acoustic) ray-splitting billiards. These systems are interesting in that the derivation of the associated smoothed spectral counting function can be considered as a canonical problem. This is achieved by extending a formalism developed by Berry and Howls for ordinary (without ray-splitting) billiards. Our results are confirmed by numerical computations and permit us to infer a set of rules useful in order to obtain Weyl formulas for more general ray-splitting billiards

A geometric phase gate without dynamical phases

A general scheme for an adiabatic geometric phase gate is proposed which is maximally robust against parameter fluctuations. While in systems with SU(2) symmetry geometric phases are usually accompanied by dynamical phases and are thus not robust, we show that in the more general case of a SU(2) x SU(2) symmetry it is possible to obtain a non-vanishing geometric phase without dynamical contributions. The scheme is illustrated for a phase gate using two systems with dipole-dipole interactions in external laser fields which form an effective four-level system.Comment: 4 pages, 5 figure

Online Commentary Regarding Workplace Harassment

This study aimed to examine online commentary about enacted workplace harassment conflict to determine the applicability of existing, functional definitions of workplace harassment in this new context. Online comments (N=721) were analyzed through an inductive thematic analysis to identify trends in women’s commentary about harassment in the workplace. The analysis developed nine themes of content evident in women’s discourse about workplace harassment as well as characteristics of each content theme which were compared to literature on harassment conflict. The study confirms that current, definitions of harassment closely relate to how women describe workplace harassment conflict in this new, mediated context

A generalized Pancharatnam geometric phase formula for three level systems

We describe a generalisation of the well known Pancharatnam geometric phase formula for two level systems, to evolution of a three-level system along a geodesic triangle in state space. This is achieved by using a recently developed generalisation of the Poincare sphere method, to represent pure states of a three-level quantum system in a convenient geometrical manner. The construction depends on the properties of the group SU(3)\/ and its generators in the defining representation, and uses geometrical objects and operations in an eight dimensional real Euclidean space. Implications for an n-level system are also discussed.Comment: 12 pages, Revtex, one figure, epsf used for figure insertio