Ion-induced nucleation. II. Polarizable multipolar molecules

Density functional theory is applied to ion-induced nucleation of polarizable multipolar molecules. The asymmetric nature of the ion-molecule interaction is shown to cause the sign preference in ion-induced nucleation. When the ion-molecule interaction is weak, the observed sign preference is consistent with that of the bare ion-molecule interaction potential and decreases with increasing supersaturation. However, as the ion-molecule interaction becomes stronger, the sign preference in the reversible work exhibits some nontrivial behavior. For molecular parameters applicable for CS2 and CH4, the predicted values of the reversible work of nucleation depend on the sign of the ion charge, yielding a difference in the nucleation rate by factors of 10 to 10^(2) and 10 to 10^(5), respectively

Ion-induced nucleation: A density functional approach

Density functional theory is applied to ion-induced nucleation of dipolar molecules. The predicted reversible work shows a sign preference, resulting in a difference in the nucleation rate by a factor of 10–10^2, for realistic values of model parameters. The sign effect is found to decrease systematically as the supersaturation is increased. The asymmetry of a molecule is shown to be directly responsible for the sign preference in ion-induced nucleation

Binary nucleation of sulfuric acid-water: Monte Carlo simulation

We have developed a classical mechanical model for the H2SO4/H2O binary system. Monte Carlo simulation was performed in a mixed ensemble, in which the number of sulfuric acid molecules is fixed while that of water molecules is allowed to fluctuate. Simulation in this ensemble is computationally efficient compared to conventional canonical simulation, both in sampling very different configurations of clusters relevant in nucleation and in evaluating the free energy of cluster formation. The simulation yields molecular level information, such as the shape of the clusters and the dissociation behavior of the acid molecule in the cluster. Our results indicate that the clusters are highly nonspherical as a result of the anisotropic intermolecular interactions and that a cluster with a given number of acid molecules has several very different conformations, which are close in free energy and hence equally relevant in nucleation. The dissociation behavior of H2SO4 in a cluster differs markedly from that in bulk solution and depends sensitively on the assumed value of the free energy f(hb) of the dissociation reaction H2SO4+H2O-HSO4-. H3O+. In a small cluster, no dissociation is observed. As the cluster size becomes larger, the probability of having an HSO4-. H3O+ ion pair increases. However, in clusters relevant in nucleation, the resulting ion pairs remain in contact; about 240 water molecules are required to observe behavior that resembles that in bulk solution. If a larger value of f(hb) is assumed to reflect its uncertainty, the probability of dissociation becomes negligible. A reversible work surface obtained for a condition typical of vapor to liquid nucleation suggests that the rate-limiting step of new particle formation is a binary collision of two hydrated sulfuric acid molecules. The ion pairs formed by dissociation play a key role in stabilizing the resulting cluster. The reversible work surface is sensitive to the assumed value of f(hb), thus pointing to the need for an accurate estimate of the quantity either by ab initio calculations or experiments

Angular and Polarization Response of Multimode Sensors with Resistive-Grid Absorbers

High sensitivity receiver systems with near ideal polarization sensitivity are highly desirable for development of millimeter and sub-millimeter radio astronomy. Multimoded bolometers provide a unique solution to achieve such sensitivity, for which hundreds of single-mode sensors would otherwise be required. The primary concern in employing such multimoded sensors for polarimetery is the control of the polarization systematics. In this paper, we examine the angular- and polarization- dependent absorption pattern of a thin resistive grid or membrane, which models an absorber used for a multimoded bolometer. The result shows that a freestanding thin resistive absorber with a surface resistivity of \eta/2, where \eta\ is the impedance of free space, attains a beam pattern with equal E- and H-plane responses, leading to zero cross polarization. For a resistive-grid absorber, the condition is met when a pair of grids is positioned orthogonal to each other and both have a resistivity of \eta/2. When a reflective backshort termination is employed to improve absorption efficiency, the cross-polar level can be suppressed below -30 dB if acceptance angle of the sensor is limited to <60degrees. The small cross-polar systematics have even-parity patterns and do not contaminate the measurements of odd-parity polarization patterns, for which many of recent instruments for cosmic microwave background are designed. Underlying symmetry that suppresses these cross-polar systematics is discussed in detail. The estimates and formalism provided in this paper offer key tools in the design consideration of the instruments using the multimoded polarimeters.Comment: 22 pages, 15 figure

Bethe-Salpeter equation in Minkowski space with cross-ladder kernel

A new method for solving the Bethe-Salpeter equation is developed. It allows to find the Bethe-Salpeter amplitudes both in Minkowski and in Euclidean spaces and, as a by product, the light-front wave function. The method is valid for any kernel given by irreducible Feynman graphs. Bethe-Salpeter and Light-Front equations for scalar particles with ladder + cross-ladder kernel are solved.Comment: 7 pages, 5 figures, to appear in the proceedings of the Workshop on Light-Cone QCD and Nonperturbative Hadron Physics, Cairns, Australia, July 7-15, 200

Bethe-Salpeter equation with cross-ladder kernel in Minkowski and Euclidean spaces

Some results obtained by a new method for solving the Bethe-Salpeter equation are presented. The method is valid for any kernel given by irreducible Feynman graphs. The Bethe-Salpeter amplitude, both in Minkowski and in Euclidean spaces, and the binding energy for ladder + cross-ladder kernel are found. We calculate also the corresponding electromagnetic form factor.Comment: 4 pages, 3 figures. Contribution to the proceedings of the 18th International IUPAP Conference on Few-Body Problems in Physics (FB18), Santos, Brasil, August 21-26, 2006. To be published in Nucl. Phys.

Solving the Bethe-Salpeter equation for bound states of scalar theories in Minkowski space

We apply the perturbation theory integral representation (PTIR) to solve for the bound state Bethe-Salpeter (BS) vertex for an arbitrary scattering kernel, without the need for any Wick rotation. The results derived are applicable to any scalar field theory (without derivative coupling). It is shown that solving directly for the BS vertex, rather than the BS amplitude, has several major advantages, notably its relative simplicity and superior numerical accuracy. In order to illustrate the generality of the approach we obtain numerical solutions using this formalism for a number of scattering kernels, including cases where the Wick rotation is not possible.Comment: 28 pages of LaTeX, uses psfig.sty with 5 figures. Also available via WWW at http://www.physics.adelaide.edu.au/theory/papers/ADP-97-10.T248-abs.html or via anonymous ftp at ftp://bragg.physics.adelaide.edu.au/pub/theory/ADP-97-10.T248.ps A number of (crucial) typographical errors in Appendix C corrected. To be published in Phys. Rev. D, October 199

Cross-ladder effects in Bethe-Salpeter and Light-Front equations

Bethe-Salpeter (BS) equation in Minkowski space for scalar particles is solved for a kernel given by a sum of ladder and cross-ladder exchanges. The solution of corresponding Light-Front (LF) equation, where we add the time-ordered stretched boxes, is also obtained. Cross-ladder contributions are found to be very large and attractive, whereas the influence of stretched boxes is negligible. Both approaches -- BS and LF -- give very close results.Comment: 11 pages, 7 figure

Solving Bethe-Salpeter equation in Minkowski space

We develop a new method of solving Bethe-Salpeter (BS) equation in Minkowski space. It is based on projecting the BS equation on the light-front (LF) plane and on the Nakanishi integral representation of the BS amplitude. This method is valid for any kernel given by the irreducible Feynman graphs. For massless ladder exchange, our approach reproduces analytically the Wick-Cutkosky equation. For massive ladder exchange, the numerical results coincide with the ones obtained by Wick rotation.Comment: 10 pages, 4 figure

Study of relativistic bound states for scalar theories in Bethe-Salpeter and Dyson-Schwinger formalism

The Bethe-Salpeter equation for Wick-Cutkosky like models is solved in dressed ladder approximation. The bare vertex truncation of the Dyson-Schwinger equations for propagators is combined with the dressed ladder Bethe-Salpeter equation for the scalar S-wave bound state amplitudes. With the help of spectral representation the results are obtained directly in Minkowski space. We give a new analytic formula for the resulting equation simplifying the numerical treatment. The bare ladder approximation of Bethe-Salpeter equation is compared with the one with dressed ladder. The elastic electromagnetic form factors is calculated within the relativistic impulse approximation.Comment: 30 pages, 10 figures, accepted for publication in Phys. Rev.