Theoretical study of the stereodynamics for the reaction F+HBr

The vector correlation between products and reagents for exothermic reaction F + HBr → HF + Br has been studied using a quasi-classical trajectory (QCT) method on the latest extended Lond–Eyring–Polanyi–Sato (LEPS) potential energy surface at three collision energies of 0.1 eV, 0.2 eV and 0.3 eV. Four polarization- dependent generalized differential cross-sections (2π/σ)(dσ₀₀/dω _t ), (2π/σ)(dσ₂₀/dω _t ), (2π/σ)(dσ₂₂₊/dω _t ), (2π/σ)(dσ_21?/dω _t ) have been presented in the centre of mass frame, respectively. The distribution of dihedral angle P(φ _r ), the distribution of angle between k and j ′ , P(θ _r ), are calculated. Both the influence of the collision energy and the influence of the reagent rotation on the product polarization have been studied in the present work, and the results indicate that the product rotational angular momentum j ′ is not only aligned, but also oriented along the direction perpendicular to the scattering plane. The orientation of the HF product rotational angular momentum vector j ′ depends very sensitively on the reagent rotation and also effected by the collision energy.     

Theoretical study of the stereodynamics of the He＋HD^＋ reaction

This paper investigates the stereodynamics of the reaction He+HD+ by the quasi-classical trajectory(QCT) method using the most accurate AQUILANTI surface [Aquilanti et al 2000 Mol.Phys.98 1835].The distribution P(φr) of dihedral angle and the distribution P(θr) of angle between k and j have been presented at three different collision energies.Four generalized polarization-dependent differential cross-sections(2π/σ)(dσ00/dωt),(2π/σ)(dσ20/dωt),(2π/σ)(dσ22+/dωt),(2π/σ)(dσ21 /dωt) are also calculated.Some interesting results are obtained from the comparison of the stereodynamics of the title reaction at different collision energies.     

H1+,H2+,H3+和He,Ne,Ar碰撞过程中的巴耳末系Hα,Hβ,Hγ发射

实验利用TN-1710光学多道分析系统(OMA),对H₁⁺,H₂⁺,H₃⁺和He,Ne,Ar碰撞过程中产生的巴耳末系H_α,H_β,H_γ发射进行了测量,入射离子H₁⁺,H₂⁺,H₃⁺的 关键词：     

Stereodynamics of the reactions Ne+H₂⁺/Ne+D₂⁺/Ne+T₂

The vector correlations between products and reagents for the reactions Ne+H + 2 , Ne+D + 2 , and Ne+T + 2 are calculated by means of the quasi-classical trajectory method on a new potential energy surface constructed by Lü et al. [J. Chem. Phys. 2010 132, 014303]. The polarization-dependent differential cross-sections (2π/σ)(dσ 00 /dω t ), (2π/σ)(dσ 20 /dω t ), (2π/σ)(dσ 22+ /dω t ), and (2π/σ)(dσ 21 /dω t ), and the distributions of P (θ r ), P (φ r ), and P (θ r ,φ r ) are calculated. The isotopic effect, which is associated with the difference in mass factor among the three reactions, is revealed.     

The energy dependence of single particle spectra in e+e− annihilation

We present explicit predictions of the statistical bootstrap model for inclusive single particle spectra in e⁺e^? annihilation. The distribution (ω/σ_tot·E) (dσ/p² dp) is found to become, for E ? 3 GeV, a function only of the secondary energy ω, independent of the incident e⁺d^? energy E.     

Influence of the reagent vibration on the stereo-dynamics of the reactions D- + H2 and H- + D2

Employing the quasi-classical trajectory method and the potential energy surface of Panda and Sathyamurhy [Panda A N and Sathyamurthy N 2004 J. Chem. Phys. 121 9343], the effect of the reagent vibration on vector correlation of the ion-molecule reactions D^- + H₂ and H^- + D₂ is studied at a collision energy of 35.7 kcal/mol. Four generalized polarization-dependent differential cross sections (2π/σ)(dσ₀₀/dω_t),(2π/σ)(dσ₂₀/dω_t),(2π/σ)(dσ₂₂/dω_t), and (2π/σ)(dσ₂₀/dω_t) are presented in the centre-of-mass reference frame, separately. At the same time, the effects on the product angular distributions P(θ_r), P(φ_r) and P(θ_r,φ_r) of the title reactions are also analysed. The calculated results show that the scattering tendencies of the product HD, the alignment and the orientation of j' sensitively depend on reagent molecule vibration.     

Theoretical study of stereodynamics for reaction O(3P)+HCl

<正>The vector correlation between products and reagents for reaction O(~3P)+HCl→OH+Cl is studied using a quasiclassical trajectory(QCT) method on the benchmark potential energy surface of the ground ~3A" state[Ramachandran and Peterson,J.Chem.Phys.119(2003)9550].The generalised differential cross section(2π/σ)(dσ_(00)/dω_t) is presented in the centre of mass frame.The distribution of dihedral angles,P(φr),and the distribution of angles between k and j', P(θ_r),are calculated.The influence of the collision energy and the influence of the reagent rotation and vibration on the product polarization are studied in the present work.The calculated results indicate that the rotational polarization of the product molecule is almost independent of collision energy but sensitive to the reagent rotation and vibration.     

氢分子3pπ D1πu+和4pσ B″1Σu+态的预解离

运用量子亏损理论，并与参考系变换及本征通道R-矩阵法相结合，建立了描述氢分子里德伯态的预解离过程的理论方法．通过对氢分子的3pπD¹π_u⁺和4pσ B″¹Σ_u⁺电子态的预解离过程的研究，阐明其解离的机理，并给出预解离的线宽． 关键词：     

C42+的几何构型和Jahn Teller效应

用从头计算法QCISD/6-311G得到了C₄²⁺分子的10种不同的几何构型,其中包括C_s,C_∞v,C_2v,D_2h,D_∞h,D_4h,D_2d,C_3v等不同的构型.计算表明C₄²⁺的T_d构型不能稳定存在,详细讨论了T_{d 关键词： 几何构型 4}²⁺')" href="#">C₄²⁺ Jahn Teller效应     

磷分子离子(P2+)注入硅的损伤行为

本文研究了不同能量(5—600keV)和不同剂量(10¹⁴-10¹⁶atom/cm²)下的P₂⁺和P⁺注入〈100〉单晶硅后的损伤及退火行为。实验结果表明,P₂⁺注入所产生的损伤总是大于P⁺注入所产生的损伤。由移位效率之比N_D^*(mol)/2N_D^*(atom)所表征的分子效应随入射能量的改变而变化并在100keV(P₂⁺),50keV(P⁺)处达到极大值。P₂⁺与P⁺注入的样品,退火后的载流子分布也有某些区别。我们认为,产生这些分子效应的基本原因是位移尖峰效应,但当入射离子的能量较高时,还应该考虑离子、靶原子之间的多体碰撞效应的贡献。 关键词：     

Transition densities between the 01+, 21+, 41+, 02+, 22+, 11− and 31− states in 12C derived from the three-alpha resonating-group wave functions

All the multipole transition densities between the seven T = 0 states in ¹²C are calculated with the use of the microscopic 3α resonating-group wave functions which are obtained by dynamically solving the 3α relative motion with the total antisymmetrization taken into account exactly. The observed elastic and inelastic electron scattering form factors for the transition to the 2₁⁺, 4₁⁺, 0₂⁺, 1₁^?and 3₁^? states are well reproduced with no additional effective charge. The existence of a deformed intrinsic state for the 0₁⁺, 2₁⁺and 4₁⁺states is deduced by the analysis of the transition densities between them which are derived by the weak-coupling-type 3α wave functions; the intrinsic density distribution is illustrated. The monopole density distribution of the 0₂⁺, 2₂⁺ and 1₁^?, states is found to be much longer ranged than that of the 0₁⁺, 2₁⁺ and 4₁⁺ states; the 3₁^? state case is intermediate. On the basis of the transition densities between the 0₁⁺, 2₁⁺, 0₂⁺ and 2₂⁺ states, analysis is made of the transition between the shell-like states and the molecule-like states with a large spatial-structure change. Specific, effective nucleon-nucleon interactions are folded into the transition densities here obtained. The evident dependence of the radial shape of the folded nucleon-¹²C form factors on the choice of the interactions and the multi-step form factors for the excitation of the 0₂⁺, 1₁^? and 3₁^? states are discussed.     

Nonstatistical structures in the excitation functions of20Ne(16O,12C)24Mg and20Ne(16O,20Ne)16O reactions

The data on the excitation functions of²⁰Ne(¹⁶O,¹²C)²⁴Mg,²⁰Ne(¹⁶O,¹²C)²⁴Mg^*(1.37, 2⁺),²⁰Ne(¹⁶O,¹²C)²⁴Mg^*(4.12, 4⁺+4.24, 2⁺) +²⁰Ne(¹⁶O,¹²C^*(4.44, 2⁺))²⁴Mg,²⁰Ne(¹⁶O,¹²C)²⁴Mg^*(6.01, 4⁺+6.43, 0⁺),²⁰Ne(¹⁶O,²⁰Ne)¹⁶O,²⁰Ne(¹⁶O,²⁰Ne^*(1.63, 2⁺))¹⁶O, and²⁰Ne(¹⁶O,²⁰Ne^*(4.25, 4⁺))¹⁶O reactions atθ _lab=13° fromE _c.m.=22.8 to 38.6 MeV have been subjected to a statistical analysis comprising of the calculations of the distribution of cross sections, deviation functions, cross-correlation functions, summed excitation functions, cross-channel correlation coefficients and coherence widths. The analysis confirms the existence of nonstatistical structures atE _c.m.=24.6, 27.8, 31.7 and 35.5 MeV, and identifies a new structure of the same nature atE _c.m. =25.6 MeV.     

Measurement of the branching ratios for Kμ2+, Kπ2+, Ke3+ and Ke3+ decays using a magnetic spectrometer with streamer chambers

The momenta of ～30 000 charged particles from K⁺ decays were measured using a magnetic spectrometer with streamer chambers. The ratio R = Γ(K_π2⁺)/Γ(K_μ2⁺) = 0.3355 ± 0.0057 was obtained. Our values for the branching ratios are: (63.18±0.43)% for K_μ2⁺, (21.18±0.33)% for K_π2⁺, (3.33±0.51)% for K_μ3⁺, (4.99±0.54)% for K_e3⁺.     

Theoretical study of stereodynamics for the O（3P） ＋ H2 → OH ＋ H reaction

This paper employs the quasi-classical trajectory calculations to study the influence of collision energy on the title reaction on the potential energy surface of the ground ³A' triplet state developed by Rogers et al. (J. Phys. Chem. A 2000 104 2308). It calculates the product angular distribution of P(θ_r), P(φ_r) and P(θ_r, φ_r) which reflects vector correlation. The distribution P(θ_r) shows that product rotational angular momentum vectors j' of the products are strongly aligned along the relative velocity direction k. The distribution of P(φ_r) implies a preference for left-handed product rotation in planes parallel to the scattering plane. Four different polarisation-dependent cross-sections are also presented in the centre-of-mass frame. Results indicate that OH is sensitively affected by collision energies of H₂.     

Amplitude and natural-parity-exchange analysis of K±p → (Kπ)±p data at 10 GeV/c

High statistics data for the reactions K^±p → K_S⁰π^±p at 10 GeV/c are analysed. The K¹(1^?), K¹(2⁺), and K¹(3^?) resonance parameters and production cross sections are calculated. The Kπ production amplitudes are determined as a function of t and the produced Kπ mass. Isoscalar natural-parity-exchange (NPE) is dominant. The t dependence of the K^± NPE amplitudes have a cross-over at t = ?0.3 (GeV/c)² for both K¹(890) and K¹(1420) production, being more pronounced for the K¹(1420). Natural-parity-exchange interference effects are isolated. The NPE amplitudes are decomposed into pomeron-, f-, and ω-exchange contributions. S-wave Kπ production is found to be consistent with the Kπ partial-wave analyses of charge-exchange reactions.     

Radiative corrections to νμ + N → μ− + X and their effect on the determination of ϱ2 and sin2θW

We study the O(α) corrections to σ_T(ν_μ + N → μ^? + X). The coefficient of the leading O(αln m_Z) contribution is given by a general theorem as in the case of β decay, while the energy scale accompanying m_Z in the argument of the logarithm as well as mass singularities and non-logarithmic terms are obtained by a detailed quark-parton model calculation. The effect of muon mass singularities, when there is an experimental vut in the low range of the y distribution, is also investigated. Combining these new results with our previous analysis of σ_T(ν_μ + N → ν_μ + X), we calculate theSU(2)_L × U(1) parameter ?_(νμ;h)² and evaluate the effect of the O(α) corrections on the determination of sin²θ_W^exp from deep inelastic ν_μ scattering. Applying these corrections to existing data, we obtain the weigthed average sin²θ_W^exp = 0.216 ± 0.010 ± 0.004. This value when used in conjuction with our previous analysis of the W^± and Z⁰ masses provides the predictions m_W = 83.0_?2.8^+3.0 GeV and m_Z = 93.8_?2.4^+2.5 GeV. For the weak interaction angle defined by modified minimal subtraction we find sin²θ_W(m_W) = 0.215 ± 0.010 ± 0.004, which is in very good agreement with the SU(5) prediction we have recently given.     

Evidence for the Bφ decay mode of the ω(1670)

Backward production of ω(1670) is observed in the reactions K^?p→φ⁺φ^?ω⁰Λ⁰ and K^?p→φ⁺φ^?φ⁰φ⁰ for |U'_Λ|<1.0 GeV². The cross section for the ω(1670) →φ⁺φ^?ω⁰ decay mode is 1.90±0.35 μb for 8.25 GeV/c incident K^?. Evidence is presented for the importance of the sequential decay, ω(1670) → Bφ → ωφφ with a branching ratio ω(1670) → Bφ/all ω(1670) → ωφφ=1.0±_0.25^0.00.     

Electron-vibrational energy exchange in collisions of Ar atoms in the 3P2 metastable state with N2(X1S g+ ) molecules

Rate constants for electron-vibrational energy exchange Ar(³ P ₂) + N₂(X ¹Σ _g ⁺, ν = 0) → Ar(¹ S ₀) + N₂(C ³Π _u , ν′), where ν′ = 0, 1, 2, were calculated. Calculations were performed taking into account the presence of a resonance in electron scattering by N₂(X ¹Σ _g ⁺). As a result, the interaction of Ar(³ P ₂) with N₂(X ¹Σ _g ⁺, ν = 0) was characterized by attraction and, in the end, intersection of electron-vibrational potential surfaces correlating with Ar(³ P ₂) + N₂(X ¹Σ _g ⁺, ν = 0) and Ar(¹ S ₀) + N₂(C ³Π _u , ν′) at interparticle distances of 2.5–3.5 ?. Exchange interaction at which electron-vibrational transitions in the region of intersection of electron-vibrational transitions in the region of intersection of electron-vibrational potential surfaces accompanied by spin exchange were induced was calculated by the asymptotic method. The rate constants determined at 300–600 K were on the order of 10⁻¹¹−10⁻¹² cm³/s and weakly increased as the temperature grew. Mainly the C ³Π _u , ν′ = 0 state of the N₂ molecule was populated. The calculation results were in satisfactory agreement with the experimental data obtained at 300 K.     

Electroproduction of π+ mesons in the resonance region

Results on the reaction ep→e′nπ⁺ are presented in the mass range 1.355 ?W ?1.775 GeV at q₂=1GeV² and in the range 1.415 ? W ? 1.595 GeV at q²=0.6 GeV². From the angular distribution of the π⁺ meson the polarization terms σ_u + ?σ_L, σ_p and σ_I have been determined in the range of production angles 0 <θ_π⁺ ?63°     

First observation of the production and decay of the Σc+

An event with the decay chain Σ_c⁺ → Λ_c⁺ + π⁰, Λ_c⁺ → K^? + p + π⁺, has been observed in an exposure of BEBC, equipped with a track sensitive target, to the wide band neutrino beam from the SPS at CERN. The event has a unique three constraint kinematic fit to the ΔS = ?ΔQ reaction v + p → μ^? + p + K^? + π⁺ + π⁺ + π⁰ with both gammas from the π⁰ decay detected. The proton and other final state particles are identified. The masses are M(Λ_c⁺) = 2290 ± 3 MeV/c², M(Σ_c⁺) = 2457 ± 4 MeV/c² and M(Σ_c⁺) ? M(Λ_c⁺) = 168 ± 3 MeV/c². Including other data one obtains M (Σ_c⁺⁺) ? M(Σ_c⁺) = 0 ± 4 MeV/c².