Degenerate asymptotic perturbation theory

Asymptotic Rayleigh-Schrödinger perturbation theory for discrete eigenvalues is developed systematically in the general degenerate case. For this purpose we study the spectral properties ofm×m—matrix functionsA(κ) of a complex variable κ which have an asymptotic expansion εA _k κ ^k as τ→0. We show that asymptotic expansions for groups of eigenvalues and for the corresponding spectral projections ofA(κ) can be obtained from the set {A _κ} by analytic perturbation theory. Special attention is given to the case whereA(κ) is Borel-summable in some sector originating from κ=0 with opening angle >π. Here we prove that the asymptotic series describe individual eigenvalues and eigenprojections ofA(κ) which are shown to be holomorphic inS near κ=0 and Borel summable ifA _k ^* =A _k for allk. We then fit these results into the scheme of Rayleigh-Schrödinger perturbation theory and we give some examples of asymptotic estimates for Schrödinger operators.     

Adiabatic theorem in axiomatic quantum field theory

It is shown that Møller matricesS _± and scattering matrixS in axiomatic field theory can be expressed through their adiabatic analogs. In particular, it is proved under certain conditions that \(S_ - = \mathop {s\lim }\limits_{\alpha \to 0} S_\alpha (0,\infty )W_\alpha \) whereW _α is a trivial phase factor [i.e. a unitary operator of the form exp i / α ∝r(k)a ⁺ (k)a(k)dk]. Corresponding results in Hamiltonian approach are discussed.     

Study of two-phonon excitations in superfluid 4He

We explain the second branch of excitations in superfluid ⁴He observed by Cowley and Woods, by accounting for two-phonon contributions to the dynamic structure function, S(k, ω). Our theory gives a good fit with the experimental data in the high energy region for several values of momentum transfer. It is observed that the contribution to S(k, ω) due to two-phonon excitations is of the order of k² as against its k⁴ dependence reported in earlier theories.     

Long-wavelength excitations in a Bose gas at zero temperature

The long-wavelength excitations in a simple model of a dilute Bose gas at zero temperature are investigated from a purely microscopic viewpoint. The role of the interaction and the effects of the condensate are emphasized in a dielectric formulation, in which the response functions are expressed in terms of regular functions that do not involve an isolated single-interaction line nor an isolated single-particle line. Local number conservation is incorporated into the formulation by the generalized Ward identities, which are used to express the regular functions involving the density in terms of regular functions involving the longitudinal current. A perturbation expansion is then developed for the regular functions, producing to a given order in the perturbation expansion an elementary excitation spectrum without a gap and simultaneously response functions that obey local number conservation and related sum rules.Explicit results to the first order beyond the Bogoliubov approximation in a simple one-parameter model are obtained for the elementary excitation spectrum ω_k, the dynamic structure function $\text{S}$(k, ω), the associated structure function $\text{S}$_m(k), and the one-particle spectral function $\text{A}$(k, ω), as functions of the wavevector k and frequency ω. These results display the sharing of the gapless spectrum ω_k by the various response functions and are used to confirm that the sum rules of interest are satisfied. It is shown that ω_k and some of the $\text{S}$_m(k) are not analytic functions of k in the long wavelength limit. The dynamic structure function $\text{S}$(k, ω) can be conveniently separated into three parts: a one-phonon term which exhausts the f sum rule, a backflow term, and a background term. The backflow contribution to the static structure function $\text{S}$₀(k) leads to the breakdown of the one-phonon Feynman relation at order k³. Both $\text{S}$(k, ω) and $\text{A}$(k, ω) display broad backgrounds because of two-phonon excitations. Simple arguments are given to indicate that some of the qualitative features found for various physical quantities in the first-order model calculation might also be found in superfluid helium.     

Dynamics of a supercooled liquid

The theory of collective motion in liquids suggested by the authors has been found to explain successfully the recent experimental results of temperature dependent disorder in supercooled liquid gallium. Metastability limit is exhibited through a singularity of S(k, ω = 0) and corresponds to a critical value of correlation between different particles beyond which the supercooled liquid goes to the thermodynamically stable solid state.     

Polarization of phosphorescence transitions and probabilities of intramolecular nonradiative deactivation of the lowest triplet state of aromatic molecules

This study continues the experimental testing of the validity of the inductive resonance theory of dipole-dipole energy transfer from the T ₁→S ₀ transition dipole to stretching vibrations of intramolecular CH bonds of naphthalene and its hydroxy derivatives. To this end, in the series of compounds under study, the range of variation of the geometrical parameter [Φ(CH)]² of the Förster theory, which accounts for the mutual orientation of the energy donor and acceptor, is estimated. Preliminarily, the angles between the transition dipole moments of the radiative and absorptive electronic transitions (T ₁→S ₀ and S ₀→S ₁; T ₁→S ₀ and S ₀→S ₂; S ₁→S ₀ and S ₀ →S ₁; and S ₁→S ₀ and S ₀→S ₂) are measured at 77 K by the method of polarization photoselection. From the polarization measurements, the angles between the phosphorescence transition dipole moment and the plane of a molecule are determined. It was found that, upon passage from naphthalene to its β derivatives, the orientation of the dipole moment of the radiative T ₁→S ₀ transition relative to the plane of a molecule markedly changes, with the in-plane component of the dipole moment being increased by an order of magnitude. The experimentally determined rate constants of nonradiative deactivation of the T ₁ state averaged over the CH groups of the naphthalene ring system, k _nr(CH), are compared with the rate constants [Φ(CH)]² of the inductive resonance energy transfer from the dipole of the T ₁→S ₀ transition to the dipole of the CH vibrations polarized in the plane of a molecule, calculated with regard to the orientational factor [Φ(CH)]². This comparison showed that, in the series of compounds under study, a change in the orientation of the dipole moment of the radiative T ₁→S ₀ transition relative to the plane of a molecule does not affect the rate of the nonradiative T ₁?S ₀ transition. This inference is confirmed by the absence of a correlation between the rate constants k _dd(CH) calculated by us (with regard to [Φ(CH)]²) and the well-known rate constants k _nr(CH) of individual sublevels of the T ₁ state measured at T≤1.35 K for a number of organic molecules. The possible sources of discrepancy between the experimental data that k _nr(CH) is independent of [Φ(CH)]² and the predictions of the theory are considered. A conclusion is made that the electronic-vibrational energy transfer between electric dipoles is the most probable mechanism of the T ₁?S ₀ transitions, but the rate constant of the dipole-dipole energy transfer upon interaction of the electronic and vibrational dipoles in a molecule does not depend on their orientations.     

Comments on the presence of a peak in the static structure factor of an electron liquid

Emphasis is laid on the fact that the peak in the static structure factor S(k) observed in a recent experiment at k≈2k_F for conduction electrons in beryllium agrees well with the one predicted by us theoretically some time back. The error in the calculation of the pair correlation function g(r) using the experimental data on S(k) is pointed out. The position of the peak obtained in our g(r) clearly indicates that the effect of electron correlation is to condense into a Wigner lattice at a distance equal to the average interparticle separation rather than making a Mott type transition to an atomic-like state.     

Systematics of moments of dipole oscillator-strength distribution for members of the He isoelectronic sequence

An analytic representation for the oscillator-strength sums S(k) for members of the He isoelectronic sequence is proposed. The expression holds for both positive and negative values of k. The values of the moments S(k) exhibit an interesting Z-dependence, where Z is the nuclear charge. This, together with some observations on H^- and the mass polarization effect, are discussed.     

The structure factor and the transport properties of dense fluids having molecules with square well potential,a possible generalization

An analytical expression of the static structure factor S(k) has been presented, treating the square well potential as a perturbation on the hard sphere system incorporating the correct equation of state given by Carnahan and Starling (CS). Reasonable values of potential parameters are obtained from a fit with the experimental peak of S(k). The present calculation of transport coefficients for liquid sodium at 373 K, is found to be in closer agreement with the experimental data. The role of back scattering correction is also discussed.     

A mode coupling theory of higher order time correlation functions

Kawasaki's mode coupling theory [Ann. Phys. 61 (1970) 1] is used to compute time correlation functions of the form 〈A_k0(t₀) … A_kn(t_n)〉, where A_k(t) represents some slowly varying quantity. The Gaussian and Bare Vertex approximations are made, thus yielding extremely simple expressions for these higher order correlation functions. These do not contain any bare transport coefficients and suggest relatively simple tests by which the theory could be checked. Examples relating to light scattering in nonequilibrium systems and the hydrodynamics of simple fluids are presented.     

Static structure factor for a fluid with interaction of hard spheres plus two Yukawa tails

We determine the static structure factor S(k) for a fluid of hard spheres with two-Yukawa interactions through the application of the mean spherical approximation (MSA) to a multi-component system composed of hard-spheres plus double Yukawa interactions (HSDY). This S(k) depends on scaling parameters Γ_n that satisfy a system of nonlinear equations. We report explicit results for a mono-dispersed HSDY fluid and show that the hard-sphere contributions control the main peak of the S(k),while for wave vectors approaching zero, we predict a cluster peak which could be identified with that of recent experimental results of Liu et al. [Y. Liu, W.-R. Chen, S.H. Chen, J. Chem. Phys. 122 (2005) 044507-1].     

Nonradiative deactivation of the lowest triplet state of naphthalene and its hydroxy derivatives at 77 K

The validity of an inductive resonance theory of energy transfer from the T ₁→S ₀ transition dipole to overtone vibrations of molecular groups containing H and D atoms is experimentally tested for a series of compounds whose conjugation systems are similar in size. To this end, by using kinetic, spectral, and luminescent methods (measurements of the phosphorescence decay times, phosphorescence spectra, ratios between the quantum yields of phosphorescence and fluorescence at 77 K, total quantum yields of fluorescence at 293 K, and ratios between the quantum yields of fluorescence at 293 and 77 K), the deactivation processes of the lowest excited T ₁ and S ₁ states of seven emitting centers (naphthalene, its hydroxy and dihydroxy derivatives, and their monoanions) in solutions in ethanol-h ₆, ethanol-d ₆, and their 2: 1 mixtures with diethyl ether are studied. For all the compounds studied, the rate constants k _r of the radiative T ₁→S ₀ transition and the changes in the overlap integrals of the spectra of phosphorescence and absorption of overtones of CH stretching vibrations are determined. The rate constants of energy transfer k _dd(CH) from the T ₁→S ₀ transition dipole to the stretching vibrations of the CH bonds are calculated without regard for the changes in the localization and orientation of this transition dipole in the compounds under study. The contribution of an individual CH group k _nr(CH) to the total rate constant of nonradiative deactivation of the T ₁ state averaged over the CH groups of the naphthalene ring system is ascertained. A good correlation between the changes in the constants k _nr(CH) and k _dd(CH) in the series of the hydroxy derivatives of naphthalene is found, which is indicative of the inductive resonance mechanism of the energy degradation of the T ₁ state. The deviations from proportionality between the changes in these constants upon passing from naphthalene to its hydroxy derivatives, which correlate with a marked increase in the radiative constant k _nr of the hydroxy derivatives in comparison with naphthalene, indicate changes in the strength and localization of the T ₁→S ₀ transition dipole moment and in its orientation with respect to the plane of the molecule that occur due to introduction of a heteroatom, oxygen, whose lone pair of electrons enters into conjugation with the πelectrons of the naphthalene ring system.     

Dynamic structure function of liquid 3He

The dynamic structure function S(Q, ω) of liquid ³He is evaluated in the impulse approximation, based on a theoretically calculated momentum distribution n(k). The gap of n(k) at the Fermi surface gives rise to discontinuities in the slope of S(Q = const., ω) which may be detectable in neutron- or γ-ray scattering experiments.     

Calculation of the wave functions of the ground and weakly excited states of helium II

The wave functions of the ground (Ψ₀) and the first excited (Ψ_k) states of He II in the second-order approximation, i.e., up to the first two corrections to the corresponding solutions for a weakly nonideal Bose gas, are determined by the collective variable method, which was proposed by Bogolyubov and Zubarev and developed in the studies by Yukhnovskii and Vakarchuk. The functions Ψ₀ and Ψ_k = ψ_kΨ₀ are determined as the eigenfunctions of the N-particle Schrödinger equation from a system of coupled equations for Ψ₀, Ψ_k, and the quasiparticle spectrum E(k) of helium II. The results consist in the following: (1) these equations are solved numerically for a higher order approximation compared with those investigated earlier (the first-order approximation), and (2) Ψ₀ and ψ_k are derived from a model potential of interaction between He⁴ atoms (rather than from the structure factor as earlier) in which the potential barrier is joined with the attractive potential found from experiment. The height V ₀ of the potential barrier is a free parameter. Except for V ₀, the model does not have any free parameters or functions. The calculated values of the structure factor, the ground-state energy E ₀, and the quasiparticle spectrum E(k) of He II are in agreement with the experimental values for V ₀ ≈ 100 K. The second-order correction to the logarithm of Ψ₀ significantly affects the value of E ₀ and provides the asymptotics E(k → 0) = ck, while the second-order correction to ψ_k slightly affects the E(k). The second-order corrections to Ψ₀ and ψ_k have a smaller effect on the results compared with the first-order corrections, whereby the theory is in agreement with experiment; therefore, one may assume that the truncated Ψ₀ and ψ_k well describe the microstructure of He II. Thus, the series for Ψ₀ and Ψ_k can be truncated in spite of the fact that the expansion parameter is not very small (～1/2).     

Perturbed angular distributions in the presence of isotropic paramagnetic relaxation

The effect of paramagnetic relaxation on perturbed angular distributions is treated for nuclei interacting with their electronic shells via isotropic hyperfine interaction. The conditions are given under which Blume's analytical stochastic-model result for the nuclear perturbation factorsG _k (t) can be derived quantum mechanically. Systems with arbitrary nuclear spin, but electronic spinS=1/2 may be calculated without resorting to the assumption necessary forS>1/2. Explicit closed expressions forG _k (t) can be found for this particular case.     

Infrared spectrum of hydrogen in the condensed phase with high-sensitivity spectrometers: Experiments with a 0.04-cm−1 Fourier transform spectrometer in the range 1.5–12 μm

The infrared spectrum of solid and liquid hydrogen was recorded using a Fourier spectrometer. The pure rotational U transitions, U₀(0) in solid para hydrogen and U₀(1) in solid normal hydrogen, with the accompanying phonon branches were observed for the first time. In addition, the rotational double transitions S₀(0) + S₀(1) and S₀(1) + S₀(1) were identified. The identifications of these transitions are based on positions calculated by making use of gas phase molecular constants. In the liquid the double transitions are preserved but the single transitions U₀(0) and U₀(1) are entirely absent. The region of Q_1←0(J) reveals structure which has not been reported before. Its interpretation is presented.     

Dynamics and sedimentation velocity in charge-stabilized colloidal suspensions

Summary Charge-stabilized suspensions are characterized by the strong electrostatic interactions between the particles so that rather dilute systems may exhibit strong correlation resulting in a well-developed short-range order. This microstructure, quantitatively described by the pair distribution functiong(r), is rather different from that of (uncharged) hard spheres. It is shown how this difference affects the ?hydrodynamic function?H(k), which appears in the expression for the first cumulant Γ(k)=k ² D _eff(k)=k ² H(k)/S(k) of the dynamic autocorrelation function. Without hydrodynamic interaction,H(k)=D ⁰, which is the free-diffusion coefficient. Using pairwise additive hydrodynamic interaction and the lowest-order many-body theory of hydrodynamic interaction, it is found thatH(k) can deviate considerably fromD ⁰ even for systems of volume fractions ϕ as low as 10⁻³. These effects are more pronounced for collective diffusion than for self-diffusion. SinceH(k=0) is closely related to the sedimentation velocity, we have studied this quantity as a function of volume fraction. It is found that (H(0)/D ⁰) −1 scales asφ ^1/3 at low ϕ in salt-free suspensions. Paper presented at the I International Conference on Scaling Concepts and Complex Fluids, Copanello, Italy, July 4–8, 1994.     

Extension of Haag’s theorem in the case of the lorentz invariant noncommunitative quantum field theory in a space with arbitrary dimension

The generalized Haag theorem was proven in SO(1, k) invariant quantum field theory. Apart from the k + 1 variables, an arbitrary number of additional coordinates, including noncommutative ones, can occur in the theory. In SO(1, k) invariant theory new corollaries of the generalized Haag theorem are obtained. It has been proven that the equality of four-point Wightman functions in the two theories leads to the equality of elastic scattering amplitudes and thus to the equality of the total cross sections in these theories. It was also shown that at k > 3 the equality of (k + 1) point Wightman functions in the two theories leads to the equality of the scattering amplitudes of some inelastic processes. In the SO(1, 1) invariant theory it was proven that if in one of the theories under consideration the S-matrix is equal to unity, then in another theory the S-matrix equals unity as well.     

Inverse scattering with non-overdetermined data

Let A(β,α,k) be the scattering amplitude corresponding to a real-valued potential which vanishes outside of a bounded domain D⊂R³. The unit vector α is the direction of the incident plane wave, the unit vector β is the direction of the scattered wave, k>0 is the wave number. The governing equation for the waves is [∇²+k²−q(x)]u=0 in R³. For a suitable class M of potentials it is proved that if Aq₁(−β,β,k)=Aq₂(−β,β,k),∀β∈S², ∀k∈(k₀,k₁), and q₁, q₂∈M, then q₁=q₂. This is a uniqueness theorem for the solution to the inverse scattering problem with backscattering data. It is also proved for this class of potentials that if , ∀k∈(k₀,k₁), and q₁, q₂∈M, then q₁=q₂. Here is an arbitrarily small open subset of S², and |k₀−k₁|>0 is arbitrarily small.