Collisional broadening of CO<Subscript>2</Subscript> 10<Superscript>0</Superscript>0–00<Superscript>0</Superscript>1 transition absorption lines by N<Subscript>2</Subscript>O molecules

Relative coefficients of collisional broadening caused by N₂O molecules and their temperature dependences are determined for absorption lines (10⁰0–00⁰1 transition, R-branch) of the CO₂ molecule.     

Potential energy of <Superscript>∞</Superscript>H<Stack><Subscript>2</Subscript><Superscript>-</Superscript></Stack>(<Superscript>2</Superscript>∑<Stack><Subscript>u</Subscript><Superscript>+</Superscript></Stack> in the bound-state region

An accurate calculation of the lowest negative electronic state of H ₂ ^- (fixed nuclei) is reported using the CCSD(T) method and doubly augmented cc-pv5z basis set. Comparison has been made with the reference data by Senekowitsch et al. [Chem. Phys. Lett. 111 (1984) 211]. Owing to larger size of the basisset and inclusion of triple excitations, no vertical shift in this work is necessary to reproduce the asymptotics of H + H ^-. In addition, the effect of basis-set truncation is estimated, based on the complete-basis-set extrapolation method. The contribution of correlated electron-proton motion to the electron-energy curve for H₂ ^– dynamics is pointed out.Dedicated to Prof. Jií Horáek on the occasion of his 60th birthday.     

O<Subscript>2</Subscript> photodesorption from AuO<Stack><Subscript>2</Subscript><Superscript>−</Superscript></Stack> and Au<Subscript>2</Subscript>O<Stack><Subscript>2</Subscript><Superscript>−</Superscript></Stack>

Using time-resolved photoelectron spectroscopy, the decay channels of AuO₂⁻ and Au₂O₂⁻ following photoexcitation with 3.1-eV photons have been studied. For AuO₂⁻, a state with a rather long lifetime of 30 ps has been identified. Its decay path could not be determined but photodesorption can be excluded. For Au₂O₂⁻, the spectra indicate O₂ desorption after 3.1-eV photoexcitation on a time scale of 1 ps. While comparing these results on Au _n O₂⁻ with analogous data on Ag _n O₂⁻ clusters, a discernible pattern emerges: for dissociatively bound O₂(AuO₂⁻, Ag₃O₂⁻), there are long-living excited states which do not decay by oxygen desorption, while for molecular chemisorption (Au₂O₂⁻, Ag₂O₂⁻, Ag₄O₂⁻, Ag₈O₂⁻), the 3.1-eV photoexcitation triggers fast O₂ desorption with a high quantum yield.     

Two photons into π<Superscript>0</Superscript>π<Superscript>0</Superscript>

We perform a theoretical study based on dispersion relations of the reaction γγ → π ⁰ π ⁰ emphasizing the low-energy region. We discuss how the ƒ ⁰(980) signal emerges in γγ → ππ within the dispersive approach and how this fixes to a large extent the phase of the isoscalar S-wave γγ → ππ amplitude above the threshold. This allows us to make sharper predictions for the cross-section at lower energies and our results could then be used to distinguish between different ππ isoscalar S-wave parameterizations with the advent of new precise data on ππ → π ⁰ π ⁰. We compare our dispersive approach with an updated calculation employing the unitary chiral perturbation theory (U _gC PT). We also pay special attention to the role played by the σ-resonance in γγ → ππ and calculate its coupling and width to γγ, for which we obtain Γ(σ → γγ) = (1.68 ± 0.15) keV.     

On the energy of the 8<Stack><Subscript>2</Subscript><Superscript>−</Superscript></Stack> 1479-keV level in <Superscript>178</Superscript>Hf

The difference in the 332-and 326-keV transition energies from ¹⁷⁸Ta decay is measured with a magnetic β spectrometer and a γ spectrometer. The energy of the 332-keV transition (E(332) = 331 607 ± 4 eV) and the energy of the 8 ₂ ^? 1479-keV level in ¹⁷⁸Hf (E(1479) = 1479001 ± 6 eV) are determined with high accuracy.     

Conserved vector current and decays τ<Superscript>−</Superscript> → η(η′)π<Superscript>−</Superscript>π<Superscript>0</Superscript>ν<Subscript>τ</Subscript>

We use experimental data on e ⁺ e ^? → (η′)π⁺π^? and conservation of vector current to estimate the branching fractions of τ^? decay to η(η′)π^?π⁰ν_τ. The obtained values are compared to the experimental results.     

Consistent α-cluster description of the <Superscript>12</Superscript>C(0<Stack><Subscript>2</Subscript><Superscript>+</Superscript></Stack>) “hoyle” resonance

The near-threshold ¹²C(0₂⁺) resonance provides unique possibility for fast helium burning in stars, as predicted by Hoyle to explain the observed abundance of elements in the Universe. Properties of this resonance are calculated within the framework of the α cluster model whose two-body and three-body effective potentials are tuned to describe the α-α scattering data, the energies of the 0₁⁺ and 0₂⁺ states, and the 0₁⁺-state rootmean-square radius. The extremely small width of the 0₂⁺ state, the 0₂⁺ → 0₁⁺ monopole transition matrix element, and transition radius are found in remarkable agreement with the experimental data. The 0₂⁺-state structure is described as a system of three α particles oscillating between the ground-state-like configuration and the elongated chain configuration whose probability exceeds 0.9.     

EIT Ground State Cooling Scheme of <Superscript>171</Superscript>Yb<Superscript>+</Superscript> Based on the <Superscript>2</Superscript>S<Subscript>1/2</Subscript>→<Superscript>2</Superscript>P<Subscript>1/2</Subscript> Cooling Transition

We propose a method for EIT ground state cooling of ¹⁷¹Yb+ ion, which involves three light fields with detuning on a MHz scale. The steady-state mean vibrational quantum number is calculated to be less than 0.005. Efficient cooling is achievable in a motional-mode frequency range of 2π · (1.5 ± 0.5 MHz).     

Analysis of the vector form factors f<Superscript>+</Superscript><Subscript>Kπ</Subscript>(Q<Superscript>2</Superscript>) and f<Superscript>-</Superscript><Subscript>Kπ</Subscript>(Q<Superscript>2</Superscript>) with light-cone QCD sum rules

In this article, we calculate the vector form factors f⁺ _Kπ(Q²) and f^- _Kπ(Q²) within the framework of the light-cone QCD sum rule approach. The numerical values of f⁺ _Kπ(Q²) are compatible with existing theoretical calculations, and the central value of f⁺ _Kπ(0) (f⁺ _Kπ(0)=0.97) is in excellent agreement with the values from chiral perturbation theory and lattice QCD. The values of |f^- _Kπ(0)| are very large compared to the theoretical calculations and experimental data, and they cannot give any reliable prediction. At large momentum transfer with Q² > 5 GeV², the form factors f⁺ _Kπ(Q²) and |f^- _Kπ(Q²)| can either show the asymptotic behavior of or decrease more quickly than ; more experimental data are needed to select the ideal sum rules. PACS 12.38.Lg; 12.38.Bx; 12.15.Hh     

Hyperfine Interactions in Pb<Superscript>3+</Superscript>F<Stack><Subscript>8</Subscript><Superscript>−</Superscript></Stack>F<Stack><Subscript>a</Subscript><Superscript>−</Superscript></Stack> clusters in fluorite crystals

The parameters of hyperfine interactions in Pb³⁺F ₈ ^? F _a ^? tetragonal clusters of MeF₂ crystals (Me=Ca, Sr, Ba) are interpreted. The contributions of the spin polarization to the parameters of the proper hyperfine interaction and additional (ligand) hyperfine interactions are calculated in the approximation of weak binding between a charge-compensating ion F _a ^? and a cubic fragment in the tetragonal cluster. It is demonstrated that correct inclusion of the contributions from the spin polarization to the ligand isotropic hyperfine interaction for the F _a ^? ion leads to anomalously large parameters of this interaction for MeF₂ crystals. These results are in agreement with experimental data.     

Two-neutrino positron double-beta decay of <Superscript>106</Superscript>Cd for the 0<Superscript>+</Superscript> → 0<Superscript>+</Superscript> transition

The two-neutrino positron double-beta decay of ¹⁰⁶Cd for the 0 ⁺ 0⁺ transition has been studied in the Hartree-Fock-Bogoliubov model in conjunction with the summation method. In the first step, the reliability of the intrinsic wave functions of ¹⁰⁶Cd and ¹⁰⁶Pd nuclei has been tested by comparing the theoretically calculated results for yrast spectra, reduced B(E2: 0⁺ 2⁺) transition probabilities, quadrupole moments Q(2⁺) and gyromagnetic factors g(2⁺) with the available experimental data. In the second step, the nuclear transition matrix element M₂ and the half-life T_1/2² for the 0 ⁺ 0⁺ transition have been calculated with these wave functions. Moreover, we have studied the effect of deformation on the nuclear transition matrix element M₂.     

Parameters of the collisionally broadened <Emphasis Type="Italic">R22</Emphasis> absorption line of the 10<Superscript>0</Superscript>0–00<Superscript>0</Superscript>1 transition of the CO<Subscript>2</Subscript> molecule

A frequency stabilized, tuneable CO₂ laser is used to measure the unsaturated absorption coefficients of pure carbon dioxide gas at pressures of 1 and 100 Torr and temperatures of 296–700 K. The radiative transition probability and the temperature dependence of the collisional self-broadening coefficient are determined for the R22 absorption line of the 10⁰0-00⁰1 transition of the CO₂ molecule. The exponent on the temperature is found to depend on the method used to determine the collisional self-broadening coefficient.     

<Superscript>2</Superscript>H NMR investigation of the transition to the proton glass state in the Cs<Subscript>5</Subscript>H<Subscript>3</Subscript>(SO<Subscript>4</Subscript>)<Subscript>4</Subscript> · 0.5H<Subscript>2</Subscript>O crystal

A crystal of the Cs₅H₃(SO₄)₄ · xH₂O (x ≈ 0.5) (PCHS) compound, which belongs to the family of proton conductors with a complex system of hydrogen bonds, is investigated by ²H NMR spectroscopy. The temperature and orientation dependences of the ²H NMR spectra are measured and analyzed. It is established that, upon transition to the glassy phase at the temperature T _g = 260 K, the parameters characterizing the proton exchange between positions in hydrogen bonds remain unchanged to within the limits of experimental error. The protons in the two-dimensional network of hydrogen bonds in the (001) plane are dynamically disordered over possible positions down to temperatures considerably lower than the glass transition point T _g . However, water molecules are fixed at particular structural positions in the phase transition range. In PCHS crystals with a nonstoichiometric water content, this circumstance can be responsible for the frustration that leads to the formation of the glassy state.     

Odd autoionizing 2p<Subscript>1/2</Subscript><Superscript>5</Superscript>n(s<Superscript>′</Superscript>/d<Superscript>′</Superscript>) resonances of Ne excited from the 2p<Superscript>5</Superscript>3p[K]<Subscript>J</Subscript> states

Absolute photoionization cross sections for Ne atoms in the excited levels (Paschen notation ) were calculated at near threshold energies within the configuration interaction Pauli-Fock approach including core polarization. The computed spectra and the lineshape parameters of the odd parity 2p_1/2 ⁵ns^′/d^′ autoionizing resonances are found to be in good agreement with high resolution laser spectroscopic results. Guided by the theoretical results, improved analyses of the measured spectra by superimposed Fano-type profiles were achieved. Theoretical predictions are presented for resonances which have not yet been studied experimentally. In addition, we report the absolute partial photoionization cross sections for the ²P_3/2 and ²P_1/2 channel at photoelectron energies up to 7 eV. Except for the highest lying 2p₁(¹S₀) level, these cross sections monotonically decrease with energy (as reported earlier in single-electron calculations for the Ne(2p⁵3p) configuration) with branching ratios which essentially reflect the core composition of the 2p_x levels. For the 2p₁ level the resonance structure and the partial cross sections are strongly influenced by a Cooper-Seaton minimum in the d_3/2 ^′ channel,located just above the ²P_1/2 ionization limit.     

Origin of the structural local transition in the molecular impurity ion MnO<Stack><Subscript>4</Subscript><Superscript>2−</Superscript></Stack> in the K<Subscript>3</Subscript>Na(CrO<Subscript>4</Subscript>)<Subscript>2</Subscript> ferroelastic

A new model is proposed for a local transition in a Jahn-Teller impurity center in a crystal with a ferroelastic (ferroelectric) phase transition. This model is based on direct interaction of the order parameter of the phase transition in the matrix with the Jahn-Teller impurity degrees of freedom. It is shown that, under these conditions, the order parameter field can induce lifting of degeneracy of the electronic states active in the Jahn-Teller effect, which is accompanied by a transition from the Jahn-Teller effect to the pseudo-Jahn-Teller effect with its subsequent suppression. As a result, a decrease in temperature gives rise to a structural local transition in the region of the low-symmetry ferroelastic (ferroelectric) matrix phase from the many-well local adiabatic to a single-well potential. The model proposed allows interpretation of experimental data obtained in an EPR study of the molecular impurity ion MnO ₄ ^2? in the K₃Na(CrO₄)₂ ferroelastic.     

The evaluation of the branching ratios of the decays φ(1020)→2π<Superscript>+</Superscript>2π<Superscript>−</Superscript>π<Superscript>0</Superscript>, π<Superscript>+</Superscript>π<Superscript>−</Superscript>3π<Superscript>0</Superscript>

Combining the Okubo-Zweig-Iizuka rule in the decay φ→ρπ→π⁺π^?π⁰ with the ρ→4π decay amplitudes, we calculate the φ→2π⁺2π^?π⁰ and φ→π⁺π^?3π⁰ ones. The partial widths of the above φ decays are evaluated, and the excitation curves in e⁺e^? annihilation are obtained, assuming reasonable particular relations among the parameters characterizing the anomalous terms of the HLS Lagrangian. The evaluated branching ratios B_φ→π⁺_π^?_3π⁰ ≈ 2 × 10^?7 and B_φ→2π⁺_2π^?_π⁰ ≈ 7 × 10^?7 are such that, with the luminosity L=500 pb^?1 attained at DAΦNE φ factory, one may already possess about 1685 events of the decays φ→5π.     

Collisional Broadening of CO<Subscript>2</Subscript> Transition Lines 10<Superscript>0</Superscript>0–00<Superscript>0</Superscript>1 by Inert Gas Atoms at 300–700 K

The spectrum of excitation of Rydberg states of thallium atoms has been investigated using a collimated atomic beam in a two-step isotope selective laser scheme 6²P_1/2 → 6²D_3/2 → Tl** in the presence of an electric field with a strength of up to 1.5 kV/cm near the level 16F_5/2. The optical transitions 6D_3/2 → 18D_3/2 and 6D_3/2 → 16G_7/2, which were induced by an external electric field and dipole-forbidden, have been studied experimentally. The values for the scalar polarizabilities (in units сm^–1/(kV/сm)²) α₀(16F_5/2) = 3.71 ± 0.3, α₀(18D_3/2) = 11.70 ± 0.25, and α₀(16G_7/2) = 44.1 ± 0.9, which are compared with the calculated one, have been obtained. The new values of energy parameters for the states 18D_3/2 and 16G_7/2 have been determined.     

<Superscript>57</Superscript>Fe emission Mössbauer spectroscopy following dilute implantation of <Superscript>57</Superscript>Mn into In <Subscript>2</Subscript>O<Subscript>3</Subscript>

Emission Mössbauer spectroscopy has been utilised to characterize dilute ⁵⁷Fe impurities in In ₂O₃ following implantation of ⁵⁷Mn (T _1/2 = 1.5 min.) at the ISOLDE facility at CERN. From stoichiometry considerations, one would expect Fe to adopt the valence state 3 + , substituting In ³⁺, however the spectra are dominated by spectral lines due to paramagnetic Fe²⁺. Using first principle calculations in the framework of density functional theory (DFT), the density of states of dilute Fe and the hyperfine parameters have been determined. The hybridization between the 3d-band of Fe and the 2p band of oxygen induces a spin-polarized hole on the O site close to the Fe site, which is found to be the cause of the Fe²⁺ state in In ₂O₃. Comparison of experimental data to calculated hyperfine parameters suggests that Fe predominantly enters the 8b site rather than the 24d site of the cation site in the Bixbyite structure of In ₂O₃. A gradual transition from an amorphous to a crystalline state is observed with increasing implantation/annealing temperature.