Note on the derivative of the hyperbolic cotangent

In a letter to Nature (Ford G W and O'Connell R F 1996 Nature 380 113) we presented a formula for the derivative of the hyperbolic cotangent that differs from the standard one in the literature by an additional term proportional to the Dirac delta function. Since our letter was necessarily brief, shortly after its appearance we prepared a more extensive unpublished note giving a detailed explanation of our argument. Since this note has been referenced in a recent article (Estrada R and Fulling S A 2002 J. Phys. A: Math. Gen. 35 3079) we think it appropriate that it now appear in print. We have made no alteration to the original note

Use of mathematical derivatives (time-domain differentiation) on chromatographic data to enhance the detection and quantification of an unknown 'rider' peak

Two samples of an anticancer prodrug, AQ4N, were submitted for HPLC assay and showed an unidentified impurity that eluted as a 'rider' on the tail of the main peak. Mathematical derivatization of the chromatograms offered several advantages over conventional skimmed integration. A combination of the second derivative amplitude and simple linear regression gave a novel method for estimating the true peak area of the impurity peak. All the calculation steps were carried out using a widely available spreadsheet program. (C) 2003 Elsevier B.V. All rights reserved

Multi-scale Renormalisation Group Improvement of the Effective Potential

Using the renormalisation group and a conjecture concerning the perturbation series for the effective potential, the leading logarithms in the effective potential are exactly summed for $O(N)$ scalar and Yukawa theories.Comment: 19 pages, DIAS STP 94-09. Expanded to check large N limit, typo's corrected, to appear in Phys Rev

Stochastic Spacetime and Brownian Motion of Test Particles

The operational meaning of spacetime fluctuations is discussed. Classical spacetime geometry can be viewed as encoding the relations between the motions of test particles in the geometry. By analogy, quantum fluctuations of spacetime geometry can be interpreted in terms of the fluctuations of these motions. Thus one can give meaning to spacetime fluctuations in terms of observables which describe the Brownian motion of test particles. We will first discuss some electromagnetic analogies, where quantum fluctuations of the electromagnetic field induce Brownian motion of test particles. We next discuss several explicit examples of Brownian motion caused by a fluctuating gravitational field. These examples include lightcone fluctuations, variations in the flight times of photons through the fluctuating geometry, and fluctuations in the expansion parameter given by a Langevin version of the Raychaudhuri equation. The fluctuations in this parameter lead to variations in the luminosity of sources. Other phenomena which can be linked to spacetime fluctuations are spectral line broadening and angular blurring of distant sources.Comment: 15 pages, 3 figures. Talk given at the 9th Peyresq workshop, June 200

Averaged Energy Conditions in 4D Evaporating Black Hole Backgrounds

Using Visser's semi-analytical model for the stress-energy tensor corresponding to the conformally coupled massless scalar field in the Unruh vacuum, we examine, by explicitly evaluating the relevant integrals over half-complete geodesics, the averaged weak (AWEC) and averaged null (ANEC) energy conditions along with Ford-Roman quantum inequality-type restrictions on negative energy in the context of four dimensional evaporating black hole backgrounds. We find that in all cases where the averaged energy conditions fail, there exist quantum inequality bounds on the magnitude and duration of negative energy densities.Comment: Revtex, 13 pages, to appear in Phy. Rev.

Measured quantum probability distribution functions for Brownian motion

The quantum analog of the joint probability distributions describing a classical stochastic process is introduced. A prescription is given for constructing the quantum distribution associated with a sequence of measurements. For the case of quantum Brownian motion this prescription is illustrated with a number of explicit examples. In particular it is shown how the prescription can be extended in the form of a general formula for the Wigner function of a Brownian particle entangled with a heat bath.Comment: Phys. Rev. A, in pres

Restrictions on Negative Energy Density in Flat Spacetime

In a previous paper, a bound on the negative energy density seen by an arbitrary inertial observer was derived for the free massless, quantized scalar field in four-dimensional Minkowski spacetime. This constraint has the form of an uncertainty principle-type limitation on the magnitude and duration of the negative energy density. That result was obtained after a somewhat complicated analysis. The goal of the current paper is to present a much simpler method for obtaining such constraints. Similar ``quantum inequality'' bounds on negative energy density are derived for the electromagnetic field, and for the massive scalar field in both two and four-dimensional Minkowski spacetime.Comment: 17 pages, including two figures, uses epsf, minor revisions in the Introduction, conclusions unchange

Casimir Force between a Dielectric Sphere and a Wall: A Model for Amplification of Vacuum Fluctuations

The interaction between a polarizable particle and a reflecting wall is examined. A macroscopic approach is adopted in which the averaged force is computed from the Maxwell stress tensor. The particular case of a perfectly reflecting wall and a sphere with a dielectric function given by the Drude model is examined in detail. It is found that the force can be expressed as the sum of a monotonically decaying function of position and of an oscillatory piece. At large separations, the oscillatory piece is the dominant contribution, and is much larger than the Casimir-Polder interaction that arises in the limit that the sphere is a perfect conductor. It is argued that this enhancement of the force can be interpreted in terms of the frequency spectrum of vacuum fluctuations. In the limit of a perfectly conducting sphere, there are cancellations between different parts of the spectrum which no longer occur as completely in the case of a sphere with frequency dependent polarizability. Estimates of the magnitude of the oscillatory component of the force suggest that it may be large enough to be observable.Comment: 18pp, LaTex, 7 figures, uses epsf. Several minor errors corrected, additional comments added in the final two sections, and references update

Ab initio Molecular Dynamical Investigation of the Finite Temperature Behavior of the Tetrahedral Au19_{19} and Au20_{20} Clusters

Density functional molecular dynamics simulations have been carried out to understand the finite temperature behavior of Au$_{19}$ and Au$_{20}$ clusters. Au$_{20}$ has been reported to be a unique molecule having tetrahedral geometry, a large HOMO-LUMO energy gap and an atomic packing similar to that of the bulk gold (J. Li et al., Science, {\bf 299} 864, 2003). Our results show that the geometry of Au$_{19}$ is exactly identical to that of Au$_{20}$ with one missing corner atom (called as vacancy). Surprisingly, our calculated heat capacities for this nearly identical pair of gold cluster exhibit dramatic differences. Au$_{20}$ undergoes a clear and distinct solid like to liquid like transition with a sharp peak in the heat capacity curve around 770 K. On the other hand, Au$_{19}$ has a broad and flat heat capacity curve with continuous melting transition. This continuous melting transition turns out to be a consequence of a process involving series of atomic rearrangements along the surface to fill in the missing corner atom. This results in a restricted diffusive motion of atoms along the surface of Au$_{19}$ between 650 K to 900 K during which the shape of the ground state geometry is retained. In contrast, the tetrahedral structure of Au$_{20}$ is destroyed around 800 K, and the cluster is clearly in a liquid like state above 1000 K. Thus, this work clearly demonstrates that (i) the gold clusters exhibit size sensitive variations in the heat capacity curves and (ii) the broad and continuous melting transition in a cluster, a feature which has so far been attributed to the disorder or absence of symmetry in the system, can also be a consequence of a defect (absence of a cap atom) in the structure.Comment: 7 figure

Anomalous diffusion in quantum Brownian motion with colored noise

Anomalous diffusion is discussed in the context of quantum Brownian motion with colored noise. It is shown that earlier results follow simply and directly from the fluctuation-dissipation theorem. The limits on the long-time dependence of anomalous diffusion are shown to be a consequence of the second law of thermodynamics. The special case of an electron interacting with the radiation field is discussed in detail. We apply our results to wave-packet spreading