Analytical representation of half-width for molecular ro-vibrational lines in the case of dipole–dipole and dipole–quadrupole interactions

The analytical formula for half-width of molecular ro-vibrational lines is obtained for the case of dipole–dipole and dipole–quadrupole interactions. This formula depends on the variable parameters, which have to be determined by fitting to experimental half-widths or to half-widths calculated by semi-classical methods. The application of the analytical formula to the H₂O–H₂O, NH₃–NH₃, DCl–HCl and CO–H₂O systems is discussed.     

Effect of pairwise dipole–dipole interaction among three-atom systems

We present an analysis of a system of three two-level atoms interacting with one another through dipole–dipole interaction. The interaction manifests between the excited state of one of the atoms and the ground state of its nearest neighbour. Steady-state populations of the density matrix elements are presented and are compared with a situation when only two atoms are present. It can be noticed that the third atom modifies the behaviour of the three atoms. Two configurations are analysed, one in which the three atoms are in a line, with no interaction between atoms at the end points and the other in which the atoms form a closed loop with one atom interacting with both its neighbours.     

Laser cooling of atoms in optical lattices including quantum statistics and dipole–dipole interactions

We develop a mean-field approach to include dipole-dipole interactions and quantum statistics in the atomic dynamics in bright and dark optical lattices including the proper spatial potentials instead of a simple δ-approximation. For classical distinguishable particles the results are even quantitatively similar to the properly scaled δ-function model. As the dominant effect bright and dark lattices exhibit opposite shifts in the lattice band energies and differ in their localisation properties as a function of density. The spatial-dependent potential allows strong modifications also in dark lattices, but the main conclusions obtained in the δ-approximation turn out to be still valid. Interestingly, important quantitative differences from the δ-model can occur as far as the effect of statistics in concerned, especially for fermions. We study the quantum statistical effects as a function of detuning and lattice well depths and identify the case of lattices with deep wells and large detunings as the preferred parameter region to observe them. Received 24 November 1999 / revised version: 24 June 1999 / Published online: 8 September 1999     

Control of excitons in a bent bunch of molecular aggregates by dipole–dipole interaction with quantum dots

The nonlocal dipole–dipole interaction is studied between excitations in chromophores forming a bunch or a tube of J-aggregates and closely spaced quantum dots (QDs). Equations describing the evolution of exciton pulses in a quasi-one-dimensional medium are derived taking into account the interaction with the transition resonant to nanoparticles. It is shown that the efficient controllable resonance energy transfer can occur in the system between QDs and an exciton pulse. The efficiency of this process significantly increases if the bunch of aggregates is deformed to bend nanoparticles round. It is shown that the interaction of permanent dipole moments of QDs and chromophores leads to the formation of a potential barrier or a well. It is found that the combined influence of these factors can be used to efficiently control the dynamics of pulses in aggregates.     

Improvement of spectral resolution by using the excitation dependence of dipole–dipole interaction in a dense atomic gas

We have studied the selective reflection from the interface between a dense rubidium (Rb) atomic vapor and a transparent dielectric. A remarkable narrowing of the spectrum, which can be used to improve the resolution of spectroscopy of dense media, has been demonstrated. This narrowing results from the reduction of the dipole–dipole interaction between atoms when the Rb vapor is excited by a strong pump laser. By using this technique, we have resolved the hyperfine structure of the Rb D₂ line, which is hidden by collisional broadening. PACS 32.70.Jz; 42.50.Ct; 34.80.Dp     

Dynamic dipole–dipole induction of coherence among a quantum dot ensemble

The quantum mechanical dynamic resonance due to dipole–dipole interaction is shown possibly to induce coherent modes of electrons within an ensemble of two-level systems or quantum dots. The physical origin of this coherence would naturally be postulated as the parity inheritance into a site being excited from another site being de-excited. An experimental spectrum suggestive of this dipole–dipole mode is also shown. This coherence is expected to be useful for quantum computing.     

Influence of steric hindrance on luminescence anisotropy of resonance dipole–dipole transfer of electronic excitation energy

An orientation factor is calculated and the effect of steric hindrance in the donor and acceptor molecules is found for the efficiency of resonance dipole–dipole transfer of electronic energy. General expressions for the acceptor luminescence anisotropy under such conditions in isotropic media (gases and liquids) are obtained taking into account orientational relaxation in ensembles of donors and acceptors. It is shown that the luminescence anisotropy of an acceptor with significant steric hindrance can increase by more than an order of magnitude compared with the case with no hindrance.     

1H–13C hetero-nuclear dipole–dipole couplings of methyl groups in stationary and magic angle spinning solid-state NMR experiments of peptides and proteins

¹³C NMR of isotopically labeled methyl groups has the potential to combine spectroscopic simplicity with ease of labeling for protein NMR studies. However, in most high resolution separated local field experiments, such as polarization inversion spin exchange at the magic angle (PISEMA), that are used to measure ¹H–¹³C hetero-nuclear dipolar couplings, the four-spin system of the methyl group presents complications. In this study, the properties of the ¹H–¹³C hetero-nuclear dipolar interactions of ¹³C-labeled methyl groups are revealed through solid-state NMR experiments on a range of samples, including single crystals, stationary powders, and magic angle spinning of powders, of ¹³C₃ labeled alanine alone and incorporated into a protein. The spectral simplifications resulting from proton detected local field (PDLF) experiments are shown to enhance resolution and simplify the interpretation of results on single crystals, magnetically aligned samples, and powders. The complementarity of stationary sample and magic angle spinning (MAS) measurements of dipolar couplings is demonstrated by applying polarization inversion spin exchange at the magic angle and magic angle spinning (PISEMAMAS) to unoriented samples.     

Quantum–classical correspondence and the role of the dipole function in molecular dissociation

We consider the quantum and classical dissociation dynamics of heteronuclear diatomic molecules induced by infrared laser pulses. The field–molecule interaction is given by the product of the time-dependent electric field and the molecule permanent dipole. We investigate the influence of the dipole function in molecular dissociation. We show that the dissociation can be suppressed at certain external field frequencies for a nonlinear and finite-range dipole function. The correspondence between quantum and classical results is established by relating classical Fourier amplitudes to discrete–continuum quantum matrix elements.     

Coherence transfer between nuclear spins in paramagnetic systems: effects of nucleus—electron dipole—dipole cross-correlation

In nuclear magnetic resonance of paramagnetic systems, cross-correlations between the fluctuations of a nucleus—nucleus dipole—dipole coupling I^k I^l and a nucleus—electron dipole coupling I^kS induces cross-relaxation and makes it possible to generate bilinear terms in the density matrix of the type 2I^k _xI^l _z from coherence I^k _x that can lead to ‘relaxation-allowed’ coherence transfer between two nuclei I^k and I^l . In this paper these effects are demonstrated in a complex involving a fragment of double-stranded DNA and two chromomycin molecules complexing a paramagnetic cobalt ion. Analytical expressions are given for the cross-correlation rates in particular conditions, while the extension to anisotropic g tensors or zero field splittings are addressed. It is shown that relaxation-allowed coherence transfer leads to characteristic signals in double-quantum filtered correlation spectroscopy (DQF—COSY), but not in total correlation spectroscopy (TOCSY). Analytical expressions are unable to reproduce the observed cross-peak patterns. A careful numerical study reveals that in the high spin Co(II) complex studied here, the cross-correlation dynamic shift contribution is of the same order of magnitude as the cross-correlation rate, a value much larger than what can be computed assuming isotropic Brownian motion and complete separation between the electron spin and the lattice.     

Chain structures and clusters of particles with the mixed dipole–quadrupole interaction in smectic freely suspended nanofilms

The formation of unusual chain structures and clusters of particles with the mixed dipole–quadrupole interaction has been found in smectic nanofilms. Unlike topological dipoles and quadrupoles, the interaction between which leads to the formation of structures with finite interparticle distances, the particles with the mixed interaction touch each other and form stable chains and two-dimensional clusters. The orientation of particles in chains is intermediate between dipole and quadrupole chains. The variation of the interparticle distance and orientation of chains is explained qualitatively on the basis of the calculation of the с-director (field lines) near particles and the mutual arrangement of particles providing the minimum distortion of field lines.     

Coherent manipulation and guiding of Bose–Einstein condensates by optical dipole potentials

The coherent manipulation of Bose–Einstein condensates by far blue detuned optical dipole potentials is discussed in two regimes. The local manipulation of the phase of the condensate wavefunction by temporally applied dipole potentials represents a powerful tool for the design of matter waves. We use this method in particular for the creation of dark solitons in Bose–Einstein condensates and study their dynamics. Spatially inhomogeneous dipole potentials like far blue detuned doughnut laser beams can be used for the creation of Bose–Einstein condensates within a waveguide structure.     

Limits on a nucleon–nucleon monopole–dipole coupling from spin relaxation of polarized ultra-cold neutrons in traps

A new limit is presented on the axion-like monopole–dipole P, T-non-invariant interaction in a range (10⁻⁴–1) cm. The spin-dependent nucleon–nucleon potential between neutrons and nucleons of the walls of the cavity containing ultra-cold neutrons should affect the neutron depolarization probability at their reflection from the walls. The limit is obtained from existing data on the ultra-cold neutron depolarization probability per one collision with the walls.     

Position-dependent property of resonant dipole—dipole interaction mediated by localized surface plasmon of an Ag nanosphere

We use the photon Green-function method to study the quantum resonant dipole-dipole interaction(RDDI) induced by an Ag nanosphere(ANP).As the distance between the two dipoles increases,the RDDI becomes weaker,which is accompanied by the influence of the higher-order mode of the ANP on RDDI declining more quickly than that of the dipole mode.Across a broad frequency range(above 0.05 eV),the transfer rate of the RDDI is nearly constant since the two dipoles are fixed at the proper position.In addition,this phenomenon still exists for slightly different radius of the ANPs.We find that the frequency corresponding to the maximum transfer rate of RDDI exhibits a monotonic decrease by moving away one dipole as the other dipole and the ANP are kept fixed.In addition,the radius of ANP has little effect on this.When the two dipoles are far from the ANP,the maximum transfer rate of the RDDI takes place at the frequency of the dipole mode.In contrast,when the two dipoles are close to the ANP,the higher-order modes come into effect and they will play a leading role in the RDDI if they match the transition frequency of the dipole.Our results may be used in a biological detector and have a certain guiding significance for further application.     

Quantum-electrodynamic modification of atomic dipole matrix element in a strong converging laser field

In this paper we report at the first time a quantum-electrodynamic modificationresult to the dipole transition matrix elements related to the bound levels of an atom in a strongconverging laser field.When the laser intensity increases,the dipole matrix elements increaseat first.However,further intensity increase will bring about the matrix elements decrease.That means the dipole transition probability is suppressed.     

Molecular dynamics simulation of dielectric constant and cluster structure of liquid methanol: the role of cluster–cluster dipole correlations

A molecular dynamics simulation of liquid methanol at ambient conditions with two different three-site potential models was performed and the evaluated dielectric constant was discussed in the light of the cluster structure of the liquid. The distribution of the pair interaction energy of molecules and the cluster size distribution were calculated. An aggregation contribution to dielectric constant was defined and calculated as a function of the threshold H-bond energy using energetic criterion of H-bond. The structural information on dipole–dipole correlations of molecules incorporated in the size and structure distribution of aggregates proved to cover about 80% of the calculated dielectric constant of methanol. The other 20% should be attributed to the cluster–cluster dipole correlations.     

Origin of tweed in Au–Cu–Al alloys

The premartensitic tweed in Au–Cu–Al alloys, contrary to previous thought that resort to defects, is confirmed to be associated with the coherent embryos of an intermediate phase (I phase) embedded in parent phase. The parent?→?I phase transformation temperature was measured by differential scanning calorimeter and dynamic mechanical analysers, which shifts from 82.3 to 557.6?°C depending on the alloy composition. X-ray diffraction and transmission electron microscopes (TEM) results show that the parent?→?I phase transformation is a charge density wave transition that cannot be suppressed even by melt-spun method, which shows obvious compositional inhomogeneity between I phase and parent. The results imply that the parent?→?I phase transition is a fast displacive transformation coupled with diffusion. Moreover, accompanying the parent?→?I phase transformation, alloys demonstrate diversified microstructure revealed by TEM observation, from tweed to chessboard nanowires or twins. These findings provide the experimental evidence for that parent?→?I phase transformation in Au–Cu–Al alloys is originated from pseudospinodal decomposition as theoretically predicted.     

Admixture of the giant dipole resonance to low lying 1−-states in heavy nuclei

The mass of ¹³ Be has been measured with the reaction ¹³ C(¹⁴ C,¹⁴ O)¹³ Be at E _Lab =337 MeV. A Q-value of Q ₀=–37.02(5) MeV was obtained and the mass excess is M.E.=35.16(5) MeV. If the observed line corresponds to the ground state,¹³ Be is particle unstable with respect to the oneneutron emission by 2.01 MeV. The observed line width of 0.3(2) MeV supports an assignment ofJ =5/2⁺ or 1/2^–, but excludesJ =1/2⁺. An excited state is seen at 3.12(7) MeV; there are indications of a second excited state at 6.5(2) MeV.