量子光学态的Ridgelet变换

利用有序算符内积分技术推导出一个有用的双模算符正规乘积公式. 然后在量子力学框架下, 计算出相干态、特殊压缩相干态、中介纠缠态表象的Radon变换. 在此基础上, 通过选取“墨西哥帽”母小波函数, 分别分析了以上三种量子光学态的Ridgelet变换. 关键词： 有序算符内积分技术 Radon变换 Ridgelet变换     

基于p1-p2与a1+a2共同本征态的相干纠缠态表象的构建及性质

利用有序算符乘积内的积分技术（IWOP）,建立了一种称之为相干纠缠态的两粒子体系的新表象,研究了这种新表象的性质,从理论上探讨了这种相干纠缠态的产生方法.结果表明：本文建立的这种p₁-p₂与a₁+a₂的共同本征态|p,β〉,既具有相干态的特性,又体现了纠缠态的特征,具有超完备性,完全可以作为一个表象使用. 物理上可以用光分束器来实现|< 关键词： IWOP技术 相干纠缠态表象 分束器     

两体组合坐标表象的建立、性质及应用

为了研究具有相互作用势和运动耦合的两个非全同的量子谐振子体系的动力学问题,利用有序算符乘积内的积分技术,建立了一种两粒子体系的组合坐标新表象|η₁,η₂〉,构造了一个双模压缩算符U并分析了其压缩特性. 应用组合坐标新表象严格求解了具有相互作用势和运动耦合的两个非全同的量子谐振子体系的动力学问题. 这为研究复杂耦合量子谐振子体系提供了一个有效途径. 关键词： 有序算符乘积内的积分技术 组合坐标表象 双模压缩算符 幺正矩阵     

量子光学理论中双模厄米多项式的新应用

强调双模厄米多项式在量子光学理论中的地位,认为它是研究连续变量纠缠态和压缩态的必要函数,具有明确的物理意义。利用双模厄米多项式,结合有序算符内的积分技术,给出了若干新的算符恒等式和互逆的积分变换公式,证明了压缩双模粒子数态恰好是双变量厄米多项式激发压缩真空态。     

新纠缠态表象的构建及其性质

运用有序算符内积分(IWOP)技术,构建了(x)2—p1和.(x)1—P2的共同本征态｜η〉,并分析了该新纠缠表象的Schmidt分解形式.另外,我们还得到纠缠态｜η>的共轭态｜ξ〉,同时计算了它们的内积.最后我们给出了新双模压缩算符S2=μ∫d2η/π｜μη〉〈η｜的显式,并分析了其压缩特性.     

利用IWOP技术构建量子力学新表象

基于对坐标表象、动量表象及相干态表象完备性关系式的正规乘积内纯高斯积分形式的分析,阐述了利用有序算符内的积分技术构建量子力学新表象的思路和方法,并具体以单模坐标-动量中介表象、双模纠缠态表象和双模相干纠缠态表象的构建为例进行了论述.     

玻色算符的逆算符及其相关的奇偶相干态

利用玻色算符的逆算符a^^-1和a^^+-1，定义了一类新的奇偶相干态 ，即增、减光子奇偶相干态.它们分别是算符为a^^-ka^^k+2,a^^+-ka ^²a^^+k的本征态，可由a^^-k和a^^+-k分别作用于通常的奇偶相干态来产生. 数值计算结 果表明，这类新的奇偶相干态都是非经典的光场态，它们都能呈现出光子反群聚效应 关键词： 玻色算符的逆算符 奇偶相干态 光子反群聚效应 量子压缩效应     

基于纠缠态表象的复脊波变换理论

本文基于连续变量量子态构造小波变换的研究结果, 从经典信息的连续脊波变换出发, 利用有序算符内ket-bra型积分, 构造连续复脊波变换对应的量子算符和表象表示, 采用表象的内积运算与态矢投影展开, 研究量子光学态的复脊波变换理论. 关键词： 有序算符内积分技术 复脊波变换 纠缠态表象 相干态     

非简并双光子Jaynes-Cummings模型中贝尔非定域性的演化

基于赝自旋算符的关联所对应的贝尔算符期待值,研究了各种双模非经典态(纠缠相干态、对相干态以及双模压缩真空态)在非简并双光子Jaynes-Cummings模型中贝尔非定域性的动力学特性.结果表明:对于纠缠相干态,贝尔非定域性的演化与双模场平均光子数的大小息息相关;对于对相干态和双模压缩真空态,贝尔非定域性会在有限的时间内完全消失,之后又基本上复原到初始值,呈现出周期性振荡现象.     

单双模连续压缩真空态及其量子统计性质

利用有序算符内的积分技术研究了通过双模压缩算符作用于两个单模压缩 态上得到的单双模 连续压缩态. 导出了单双模连续压缩算 符的正规乘积形式, 并在此基础上研究了单双模连续压缩真空态的量子统计性质. 特别是利用Weyl编 序算符在相似变换 下的不变性, 简洁地导出了单双模连续 压缩真空态的Wigner函数. 最后, 还简单地提出 了单双模连续压缩 真空态的实验产生方案.     

New theorem relating two-mode entangled tomography to two-mode Fresnel operator

Based on the Fan-Hu's formalism, i.e., the tomogram of two-mode quantum states can be considered as the module square of the states' wave function in the intermediate representation, which is just the eigenvector of the Fresnel quadrature phase, we derive a new theorem for calculating the quantum tomogram of two-mode density operators, i.e., the tomogram of a two-mode density operator is equal to the marginal integration of the classical Weyl correspondence function of F₂⁺ρF₂, where F₂ is the two-mode Fresnel operator. An application of the theorem in evaluating the tomogram of an optical chaotic field is also presented.     

GaH(D,T)分子基态结构与势能函数

采用量子力学从头计算方法,运用单双取代二次组态相互作用和单双（三）取代二次组态相互作用并考虑基组6-311++G（3df,3pd）计算优化了GaH（D,T）分子基态X¹Σ⁺的结构和离解能.并采用最小二乘法拟合改进的Murrell-Sorbie函数得到了相应的势能函数.计算得到的光谱常数与实验光谱数据符合得很好. 关键词： GaH（D T）分子基态 势能函数 Murrell-Sorbie函数     

用耦合簇理论及相关一致五重基研究SiH$lt;sub$gt;2$lt;/sub$gt;($lt;i$gt;X$lt;/i$gt;$lt;sup$gt;1$lt;/sup$gt;$lt;i$gt;A$lt;/i$gt;$lt;sub$gt;1$lt;/sub$gt;)自由基的解析势能函数

运用单双迭代三重激发耦合簇理论和相关一致五重基对SiH₂的基态结构进行了优化, 并在优化结构的基础上进行了离解能和振动频率的计算. 结果表明: SiH₂的基态为C_2v结构, 平衡核间距R_Si—H= 0.15163 nm, H—Si—H键的键角α=92.363°, 离解能D_e（HSi—H）=3.2735 eV, 频率ν₁（a₁）=1020.0095 cm^-1, ν₂（a₁）=2074.8742 cm^-1, ν₃（a₁）=2076.4762 cm^-1. 这些结果与实验值均较为相符. 对H₂的基态使用优选出的cc-pV6Z基组、对SiH的基态使用优选出的aug-cc-pV5Z基组进行几何构型与谐振频率的计算并进行单点能扫描, 且将扫描结果拟合成了解析的Murrell-Sorbie函数. 与实验结果及其他理论计算结果的比较表明, 本文关于SiH自由基光谱常数（D_e,R_e, ω_e, B_e, α_e和ω_eχ_e）的计算结果达到了很高的精度. 采用多体项展式理论导出了SiH₂（C_2v, X¹A₁）自由基的解析势能函数, 其等值势能图准确再现了它的离解能和平衡结构特征. 同时还给出了SiH₂（C_2v, X¹A₁）自由基对称伸缩振动等值势能图中存在的两个对称鞍点, 对应于SiH+H→SiH₂反应, 势垒高度为0.5084 eV. 关键词： 2')" href="#">SiH₂ Murrell-Sorbie函数 多体项展式理论 解析势能函数     

Rotationally resolved state-to-state photoelectron study of zirconium monoxide cation (ZrO+)

Using two-colour visible (Vis)–ultraviolet (UV) photoionisation and pulsed field ionisation–photoelectron (PFI–PE) methods, we have obtained cleanly rotationally resolved photoelectron spectra for ZrO⁺(X ²Δ_3/2,5/2; v⁺ = 0, 1, and 2). The rotation assignment of these state-to-state Vis–UV–PFI–PE spectra has allowed the unambiguous determination of the ground state term symmetry for ZrO⁺(X) to be ²Δ_3/2, and the adiabatic ionisation energy of ⁹⁰Zr¹⁶O, IE(⁹⁰Zr¹⁶O) = 54,948.3(8) cm^?1 [6.81272(10) eV]. The symmetry of the ionic ZrO⁺(X ²Δ_3/2) ground state determined here disagrees with that reported in previous experiments. The rotational and vibrational constants determined in this experiment for the ionic ⁹⁰Zr¹⁶O⁺(X ²Δ_3/2) ground state are: B_e⁺ = 0.4343(8) cm^?1 and α_e⁺ = 0.0019(5) cm^?1, and ω_e⁺ = 991.2(8) cm^?1 and ω_e⁺x_e⁺ = 3.5(8) cm^?1; and those for the ionic ⁹⁰Zr¹⁶O⁺(X ²Δ_5/2) excited spin-orbit state are: B_e⁺ = 0.4357(6) cm^?1 and α_e⁺ = 0.0022(4) cm^?1, and ω_e⁺ = 991.9(8) cm^?1 and ω_e⁺x_e⁺ = 3.6(8) cm^?1, respectively. Based on the latter B_e⁺ value, the equilibrium bond distances are determined to be r_e⁺ = 1.691(2) Å for ⁹⁰Zr¹⁶O⁺(X ²Δ_3/2) and r_e⁺ = 1.688(1) Å for ⁹⁰Zr¹⁶O⁺(X ²Δ_5/2). The IE(ZrO) along with the spectroscopic constants obtained here are valuable for benchmarking the ab initio quantum chemical calculations for energetic and structural predictions of ZrO/ZrO⁺.     

High-resolution F T spectrum of A2Πr-X2Σ+ band system of MgCl

The emission spectrum of the A ² Π _r -X ² Σ ⁺ band system of MgCl molecule (360–380 nm) has been recorded on BOMEM DA8 Fourier transform spectrometer at an apodized resolution of 0.035 cm⁻¹. The spectra have been excited under flowing conditions in a demountable stainless steel hollow cathode lamp (400 V, 250 mA) containing anhydrous MgCl₂ and Ar. The resulting spectra are very intense and the 0-0, 1-1, 1-0 bands of A ² Π _1/2-X ² Σ ⁺ sub-transition and the 0-0 band of A ² Π _3/2-X ² Σ ⁺ sub-transition have been rotationally analyzed. Improved molecular constants have been derived using a least-squares fit program in which optical data of earlier analyzed 0-1 and 0-2 bands (A ² Π _1/2-X ² Σ ⁺) was also included. The Λ-doubling constants in the v′ = 0, 1 levels of the A ² Π _1/2 sub-state are as expected, i.e. p ₁ > p ₀, where as it is found that the spin-doubling constants of the v″ = 0, 1 and 2 levels of the ground state X ² Σ ⁺, decrease with the increase in v, i.e. γ ₀ > γ ₁ > γ ₂. This is indicative of the presence of some nearby state, influencing the spin-doubling.     

The Ground StateXΣof NaK Revisited

Laser-induced fluorescence (LIF) optical spectra of theD¹Π–X¹Σ⁺system of the NaK molecule have been reinvestigated. In this new analysis, quantum numbers have been assigned to 3000 selected fluorescence lines for a wide range of vibrational and rotational levels (J≤ 149,v′ ≤ 23,v″ ≤ 47). A new set of constants of theX¹Σ state (Dunham-type coefficients) and term values of theD¹Π state have been determined by a weighted least-squares fit of the LIF optical lines of theD–Xsystem, some lines of theC–Xsystem, and microwave spectral data reported recently. Constants forX¹Σ (in cm⁻¹) are as follows: ω_e= 123.993, ω_ex_e= 0.3045,B_e= 0.095229, and α_e= 4.48 × 10⁻⁴. The equilibrium internuclear distance isr_e= 3.49903 Å, very little changed from the microwave value.     

Higher-order Hong-Mandel's squeezing in superposed coherent states

We study 2nth order Hong and Mandel's squeezing of the Hermitian operator, X_θ ≡ X₁cosθ + X₂sinθ in the most general superposition state, |ψ〉 = Z₁|α〉 + Z₂|β〉 of two coherent states |α〉 and |β〉. Here operators X_1,2 are defined by X₁ + i X₂ = a, the annihilation operator, angle θ and complex numbers Z_1,2 , α, β are arbitrary and the only restriction on these is the normalization condition of |ψ〉. We find maximum 2nth-order Hong-Mandel squeezing of X_θ in the superposed coherent state |ψ〉 for an infinite combinations with , and with arbitrary values of (α + β) and θ. Here A_2n is a constant which depends on the order of squeezing. The maximum percentage of 2nth order Hong-Mandel squeezing and their respective constants A_2n have been reported for some values of n. We conclude that any large percentage of squeezing can be obtained by suitably choosing of the order 2n. For the order greater than 128 we obtained more than 99% higher-order squeezing at very low intensity of the optical field. Variations of higher-order squeezing with different parameters near its maxima have also been discussed.     

Studies on the full vibrational energy spectra for some electronic states of diatomic molecular ions XY+

The first accurate studies on the vibrational spectroscopic constants and the corresponding full vibrational energy spectra of some electronic states of diatomic molecular ions XY⁺ were performed using algebraic method(AM). The AM is applied on the X¹Σ⁺ state of BeH⁺, the X²Σ⁺ state of CO⁺, the X²Π_g state of F ₂ ⁺ , the A²Π_u state of O ₂ ⁺ and the X²Σ _g ⁺ state of Li ₂ ⁺ . The results show that AM can generate accurate vibrational spectroscopic constants as well as accurate full vibrational energy spectra by using some accurate experimental vibrational energies, and that the AM vibrational energies are better than other theoretical data. __________ Translated from Chinese Journal of Atomic and Molecular Physics, 2005, 22 (4) (in Chinese)     

Studies on the analytical potential energy function of diatomic molecular ion XY<Superscript>+</Superscript> using variational method

A new analytical potential energy function for diatomic molecular ion XY⁺ is proposed based on the energy consistent method (ECM). The Coulomb potential included in the new ionic potential contains multipole corrections, converges quickly and is variationally, changeable. The new potential and the ECM are applied to variationally studying the potential energies of eight electronic states of several diatomic molecular ions: the A²π state of CO⁺, the X²∑_g⁺ state of Li₂⁺, the X²∑_g⁺ state of He₂⁺, the 1²∏_u state of Na₂⁺, the A²∏_u state of N₂⁺, the X¹∑⁺ state of KrH⁺, the X²∑⁺ state of SiO⁺ and the A²π state of SO⁺ ion. The present results agree excellently with the experiment-based Rydberg-Klein-Rees (RKR) potentials, and are superior to the commonly used Huxley-Murrell-Sorbie (HMS) analytical potentials, and are better in some cases than some quantum mechanicalab initio potentials in the ionic asymptotic and dissociation regions.     

用代数-能量自洽法研究双原子分子解析势能函数

基于计算双原子分子完全振动能谱及离解能的代数方法 (algebraic method,AM)和研究双原子分子解析势能函数的能量自洽法(energy consistent method,ECM),建立了计算双核分子体系精确解析势能函数的代数-能量自洽法(AM-ECM).应用AM-ECM方法研究了7Li+2-23Σg,KH-X1Σ+,NaLi-X1Σ+和NaLi-A1Σ+电子态的解析势能表达形式,并与其他方法的研究结果进行了比较,获得了能正确描述这些电子态在渐近区和离解区的精确解析表达结果.