D+CD4→CD3+D2反应的量子含时动力学研究

运用半刚体振动转子靶(semirigid vibrating rotor target)模型,利用含时波包法(TDWP method),对反应D+CD4→CD3+D2进行了量子含时动力学研究与计算.反应几率随平动能的变化图象,呈现出显著的量子共振特性.并通过对v=0时,j=0,1,2的反应几率以及j=0时,v=0,1的反应几率的计算,对该反应的空间效应进行了研究与分析.     

D+CD4→CD3+D2反应的四维量子散射计算

运用约化维数量子动力学理论 ,利用含时波包法 ,对反应D +CD4 →CD3+D2 进行了四维量子散射计算 .将反应多原子CD4 看作双原子D—CD3,反应D +CD4 →CD3+D2 看作单原子 双原子反应 ,把体系的反应简化为四维散射问题 .波函数的传播采用分裂算符法 ,为避免格点边界处含时波函数的边界反射 ,采用了光学吸收势法 ,在格点边界处引入光学势 ,消除边界反射 .根据CD4 分子的C3v对称性 ,选取了Jordan和Gilbert提出的半经验势能面 .计算结果表明 ,反应概率随平动能的变化图像 ,呈现出显著的量子共振特性 ,这是很多提取反应的共同特征 .而不同振动态下的反应概率随平动能的变化表明 ,随振动量子数的增大 ,反应概率有明显提高 ,且反应阈能明显降低 ,这说明反应分子的振动能对分子的碰撞反应有重要贡献 .而对基态和第一振动激发态时散射截面的计算 ,也证明了这一结论 .同时 ,还分别通过计算量子数j,k ,m对反应概率的影响 ,对该反应的空间取向效应进行了研究 ,并与H +CH4→CH3+H2 反应进行了比较 .     

Quasiclassical teheory of the reaction scattering AB + CD → AC + BD

A quantum-mechanical, three-dimensional, quasiclassical theory is developed for the effective cross section of the chemical reaction AB + CD AC + BD. The quasiclassical approximation is used on the basis of the Born formula for the differential effective cross section. The steady-phase method is used to calculate the integrals appearing in the formula for the differential effective cross section. An analytic solution of the problem is found. The formulas obtained are convenient for use in performing numerical calculations.Translated from Izvestiya Vysshikh Uchebnykh Zavedenii, Fizika, No. 2, pp. 57–62, February, 1982.     

用含时波包方法将SVRT模型应用到F+CD4→CD3+DF反应中

为了实现量子动力学含时波包方法对多原子反应体系的研究,采用美国纽约大学张增辉教授提出的一个半刚性振转子的模型,对F+CD4反应及其同位素反应物反应在MJ1势能面上进行了含时波包动力学的研究.所用到的势能面的反应势垒66meV.实验和理论研究表明在反应中C-D键不影响反应碰撞,它只是一个旁观者.对C-D键作为常数处理使得计算大大简化了.计算了给定初始态的这些反应的积分反应截面和速率常数.从得到的数值结果可以看出,积分截面随着碰撞能有一个很大的起伏,这一般来讲是与动力学振荡有关系.速率常数同已有的理论以及实验结果进行了比较,得到了比较合理的结论.     

采用准经典轨迹的方法研究碰撞能对C+CD→C2+D反应的影响

运用准经典轨线方法,基于¹A'势能面[Mol. Phys. 98, 1925(2000)],从理论上研究了碰撞能对C+CD→C₂+D反应的立体动力学性质的影响．计算并且详细讨论了与产物矢量相关的三个极化分布函数P(θr), P(φr)和P(θr,φr)．此外,在质心坐标系中,研究了碰撞能对两个极化微分反应截面的影响．结果表明,产物C₂的立体动力学性质对反应物分子的碰撞能非常敏感.     

On the reactions p + p↦p + Λ + K+ and p + p↦p + Σ0 + K+ near thresholds

The cross-sections for the reactions of the strange production p + p ↦ p + Λ + K⁺ and p + p ↦ p + Σ⁰ + K⁺ near thresholds of the final states pΛK⁺ and pΣ⁰K⁺ are calculated in the effective Lagrangian approach. Our approach is based on the dominant contribution of the one-pion exchange and strong interaction of the colliding protons in the initial state. The theoretical values of the cross-sections agree reasonably well with the experimental data. The polarization properties of the Λ- and Σ⁰-hyperons are discussed.     

The A1Π-X1Σ band system of CD+: Spectroscopic constants and isotope shifts

Six bands of the A¹Π-X¹Σ system of CD⁺ in the region 3800–4800 Å have been recorded in emission using an aluminum hollow-cathode discharge in the HeC₂H₂ mixture. From the vibrational and rotational analysis of the observed bands, the following constants (cm^?1) are obtained:

     

9.

Use of a multichannel method in the theory of the effective cross section of the reaction AB + CD → AC + BD in the born approximation     

V. P. Aristov  K. S. Borodin  V. V. Tolmachev 《Russian Physics Journal》1980,23(9):818-822

The Born expression for the effective differential cross section of the reaction AB + CD AC + BD is transformed to a more convenient form by means of the theory of quantum angular momentum, the theory of D functions, and the Wigner 3j and 6j coefficients.Translated from Izvestiya Vysshikh Uchebnykh Zavedenii, Fizika, No. 9, pp. 75–79, September, 1980.     

10.

On polarization of strange baryons in reactions p + p↦p + Λ0 + K+ and p + p↦p + Σ0 + K+ near thresholds     

A.Ya. Berdnikov  Ya.A. Berdnikov  A.N. Ivanov  V.A. Ivanova  V.F. Kosmach  M.D. Scadron  N.I. Troitskaya 《The European Physical Journal A - Hadrons and Nuclei》2001,12(3):341-347

Polarization properties of strange baryons produced in pp reactions, p + p↦p + Λ⁰ + K⁺ and p + p↦p + Σ⁰ + K⁺, near thresholds of the final states pΛ⁰K⁺ and pΣ⁰K⁺ are analysed relative to polarizations of colliding protons. The cross-sections for pp reactions are calculated within the effective Lagrangian approach accounting for strong pp rescattering in the initial state of colliding protons with a dominant contribution of the one-pion exchange and strong final-state interaction of daughter hadrons (Eur. Phys. J. A 9, 425 (2000)). Received: 22 October 2001 / Accepted: 14 November 2001     

11.

Search for lepton number violating decays B+ → π- μ+ μ+ and B+ → K- μ+ μ+     

Aaij R  Abellan Beteta C  Adeva B  Adinolfi M  Adrover C  Affolder A  Ajaltouni Z  Albrecht J  Alessio F  Alexander M  Alkhazov G  Alvarez Cartelle P  Alves AA  Amato S  Amhis Y  Anderson J  Appleby RB  Aquines Gutierrez O  Archilli F  Arrabito L  Artamonov A  Artuso M  Aslanides E  Auriemma G  Bachmann S  Back JJ  Bailey DS  Balagura V  Baldini W  Barlow RJ  Barschel C  Barsuk S  Barter W  Bates A  Bauer C  Bauer T  Bay A  Bediaga I  Belous K  Belyaev I  Ben-Haim E  Benayoun M  Bencivenni G  Benson S  Benton J  Bernet R  Bettler MO 《Physical review letters》2012,108(10):101601

A search is performed for the lepton number violating decay B+ → h- μ+ μ+, where h- represents a K- or a π-, using an integrated luminosity of 36 pb(-1) of data collected with the LHCb detector. The decay is forbidden in the standard model but allowed in models with a Majorana neutrino. No signal is observed in either channel and limits of B(B+ → K- μ+ μ+) < 5.4×10(-8) and B(B+ → π- μ+ μ+) < 5.8×10(-8) are set at the 95% confidence level. These improve the previous best limits by factors of 40 and 30, respectively.     

12.

Annihilation of + \bar p + p → e + + e ? + π0 and + \bar p + p → γ + π0 through an ω-Meson intermediate state     

E. A. Kuraev  Yu. M. Bystritskiy  V. V. Bytev  A. Dbeyssi  E. Tomasi-Gustafsson 《Journal of Experimental and Theoretical Physics》2012,115(1):93-104

The s-channel annihilation of a proton and an antiproton into a neutral pion and a real or virtual photon followed by lepton pair emission is studied. Such a mechanism is expected to play a role at moderate values of the total energy $ \sqrt s $ , when the pion is emitted in the angular region around 90° in the center-of-mass system. A fair comparison with the existing data is obtained taking scattering and annihilation channels into account. The cross section is calculated and numerical results are given in the kinematical range accessible in the PANDA experiment at FAIR.     

13.

CD技术的物理原理     

刘德祖  郑林  杨琴燕 《大学物理》1998,17(4):40-43

简要介绍了ＣＤ技术的物理原理，以期对物理原理在现代科技新领域中的应用有所了解。     

14.

Isotopic Effects on Stereodynamics of the C~+ + H_2→CH~+ + H Reaction     

《理论物理通讯》2017,(5)

The effects of isotope substitution on stereodynamic properties for the reactions C~+ + H_2/HD/HT →CH~+ + H/D/T have been studied applying a quasi classical trajectory method occurring on the new ground state CH_2~+ potential energy surface [J. Chem. Phys. 142(2015) 124302]. In the center of mass coordinates applying the quasi classical trajectory method to investigate the orientation and the alignment of the product molecule. Differential cross section and three angle distribution functions P(θ_r), P(ф_r), P(θ_r, ф_r) on the potential energy surface that fixed the collision energy with a value is 40 kcal/mol have been studied. The isotope effect becomes more and more important with the reagent molecules H_2 changing into HD and HT. P(θ_r, ф_r) as the joint probability density function of both polar angles θ_r and ф_r, which can illustrate more detailed dynamics information. The isotope effect is obvious influence on the properties of stereodynamics in the reactions of C~+ + H_2/HD/HT → CH~+ + H/D/T.     

15.

Cu~+、Ag~+、Au~+与乙硫醇的气相化学反应     

王娟  王进  张允武  盛六四 《原子与分子物理学报》2003,(2)

利用激光溅射 分子束的技术 ,结合反射飞行时间质谱计 ,研究了Cu+、Ag+、Au+与乙硫醇的气相化学反应。结果显示这三种金属离子与 (CH3 CH2 SH) n 反应形成一系列团簇离子M+(CH3 CH2 SH) n,且团簇离子尺寸不一样。Ag+、Au+与乙硫醇的反应还生成了 (CH3 CH2 SH) +n ,由此推测Cu+、Ag+、Au+与乙硫醇团簇的反应存在两种通道 ,一种通道是生成M+(CH3 CH2 SH) n,另一种是生成 (CH3 CH2 SH) +n 。Cu+、Au+与乙硫醇的反应还生成了M+(H2 S) (M =Cu、Au) ,但是实验中没有观察到Ag+(H2 S) ,理论计算表明Ag+(H2 S)很不稳定。另外 ,分析产物离子M+(CH3 CH2 SH) n 的强度发现 ,n =1～ 2之间存在明显的强度突变现象     

16.

Theoretical study of the stereodynamics of the He + H+ 2 → HeH+ + H reaction     

Wenwu Xu  Qinggang Zhang 《Molecular physics》2013,111(14):1787-1792

     

17.

Cu+、Ag+、Au+与乙硫醇的气相化学反应     

王娟  王进  张允武  盛六四 《原子与分子物理学报》2003,20(2):127-131

利用激光溅射-分子束的技术,结合反射飞行时间质谱计,研究了Cu+、Ag+、Au+与乙硫醇的气相化学反应.结果显示这三种金属离子与(CH3CH2SH)n反应形成一系列团簇离子M+(CH3CH2SH)n,且团簇离子尺寸不一样.Ag+、Au+与乙硫醇的反应还生成了(CH3CH2SH)+n,由此推测Cu+、Ag+、Au+与乙硫醇团簇的反应存在两种通道,一种通道是生成M+(CH3CH2SH)n,另一种是生成(CH3CH2SH)+n.Cu+、Au+与乙硫醇的反应还生成了M+(H2S)(M=Cu、Au),但是实验中没有观察到Ag+(H2S),理论计算表明Ag+(H2S)很不稳定.另外,分析产物离子M+(CH3CH2SH)n的强度发现,n=1～2之间存在明显的强度突变现象.     

18.

Search for the decay μ+ → e+e+e−     

《Nuclear Physics B》1988,299(1):1-6

     

19.

First direct evidence of a solid state charge transfer redox system Cu+2 + Mn3+ ⇋ Cu1+ + Mn4+in copper manganese oxide     

《Solid State Communications》1986,57(9):745-748

First direct experimental evidence of the redox system Cu²⁺ + Mn⁺³ ⇋ Cu¹⁺ + Mn⁴⁺ in oxidation catalysts, “Hopcalite”, is presented. The evidence is obtained from chemical shifts and shake-up satellite structure of Cu 2p, and from multiplet splitting of Mn 3s x-ray photoelectron signals.     

20.

K+-Na+和Ag+-Na+两步离子交换技术制作玻璃基光波导研究     

李锡华  金宁  宫汝振  杨建义  江晓清  王明华 《光子学报》2008,37(8):1520-1523

利用K+-Na+和Ag+-Na+两步离子交换得到掩埋型光波导.该方法抑制Ag+-Na+离子交换时产生的Ag+微粒,降低波导损耗,增加波导截面的圆对称性,从而提高光波导器件的性能.用该方法制作了1×8光功分器,其插入损耗平均为10.9 dB.     

		$\text{T}{}_{00}$		$\text{ω}{}_{\mathrm{e}}$		$\text{ω}{}_{\mathrm{e}}\text{x}{}_{\mathrm{e}}$		$\text{ω}{}_{\mathrm{e}}\text{y}{}_{\mathrm{e}}$		$\text{B}{}_{\mathrm{e}}$		$\text{D}{}_{\mathrm{e}}\text{·10}{}^4$		$\text{α}{}_{\mathrm{e}}$
$\text{A}{}^1\text{Π}$		23 747.5		1367.3		60.6		0.75		6.428		5.7		0.388
$\text{X}{}^1\text{Σ}$		0		2035						7.650		4.1		0.190
				(2101.6)		(33.3)

Use of a multichannel method in the theory of the effective cross section of the reaction AB + CD → AC + BD in the born approximation

The Born expression for the effective differential cross section of the reaction AB + CD AC + BD is transformed to a more convenient form by means of the theory of quantum angular momentum, the theory of D functions, and the Wigner 3j and 6j coefficients.Translated from Izvestiya Vysshikh Uchebnykh Zavedenii, Fizika, No. 9, pp. 75–79, September, 1980.     

On polarization of strange baryons in reactions p + p↦p + Λ0 + K+ and p + p↦p + Σ0 + K+ near thresholds

Polarization properties of strange baryons produced in pp reactions, p + p↦p + Λ⁰ + K⁺ and p + p↦p + Σ⁰ + K⁺, near thresholds of the final states pΛ⁰K⁺ and pΣ⁰K⁺ are analysed relative to polarizations of colliding protons. The cross-sections for pp reactions are calculated within the effective Lagrangian approach accounting for strong pp rescattering in the initial state of colliding protons with a dominant contribution of the one-pion exchange and strong final-state interaction of daughter hadrons (Eur. Phys. J. A 9, 425 (2000)). Received: 22 October 2001 / Accepted: 14 November 2001     

Search for lepton number violating decays B+ → π- μ+ μ+ and B+ → K- μ+ μ+

A search is performed for the lepton number violating decay B+ → h- μ+ μ+, where h- represents a K- or a π-, using an integrated luminosity of 36 pb(-1) of data collected with the LHCb detector. The decay is forbidden in the standard model but allowed in models with a Majorana neutrino. No signal is observed in either channel and limits of B(B+ → K- μ+ μ+) < 5.4×10(-8) and B(B+ → π- μ+ μ+) < 5.8×10(-8) are set at the 95% confidence level. These improve the previous best limits by factors of 40 and 30, respectively.     

Annihilation of + \bar p + p → e + + e ? + π0 and + \bar p + p → γ + π0 through an ω-Meson intermediate state

The s-channel annihilation of a proton and an antiproton into a neutral pion and a real or virtual photon followed by lepton pair emission is studied. Such a mechanism is expected to play a role at moderate values of the total energy $ \sqrt s $ , when the pion is emitted in the angular region around 90° in the center-of-mass system. A fair comparison with the existing data is obtained taking scattering and annihilation channels into account. The cross section is calculated and numerical results are given in the kinematical range accessible in the PANDA experiment at FAIR.     

CD技术的物理原理

简要介绍了ＣＤ技术的物理原理，以期对物理原理在现代科技新领域中的应用有所了解。     

Isotopic Effects on Stereodynamics of the C~+ + H_2→CH~+ + H Reaction

The effects of isotope substitution on stereodynamic properties for the reactions C~+ + H_2/HD/HT →CH~+ + H/D/T have been studied applying a quasi classical trajectory method occurring on the new ground state CH_2~+ potential energy surface [J. Chem. Phys. 142(2015) 124302]. In the center of mass coordinates applying the quasi classical trajectory method to investigate the orientation and the alignment of the product molecule. Differential cross section and three angle distribution functions P(θ_r), P(ф_r), P(θ_r, ф_r) on the potential energy surface that fixed the collision energy with a value is 40 kcal/mol have been studied. The isotope effect becomes more and more important with the reagent molecules H_2 changing into HD and HT. P(θ_r, ф_r) as the joint probability density function of both polar angles θ_r and ф_r, which can illustrate more detailed dynamics information. The isotope effect is obvious influence on the properties of stereodynamics in the reactions of C~+ + H_2/HD/HT → CH~+ + H/D/T.     

Cu~+、Ag~+、Au~+与乙硫醇的气相化学反应

利用激光溅射 分子束的技术 ,结合反射飞行时间质谱计 ,研究了Cu+、Ag+、Au+与乙硫醇的气相化学反应。结果显示这三种金属离子与 (CH3 CH2 SH) n 反应形成一系列团簇离子M+(CH3 CH2 SH) n,且团簇离子尺寸不一样。Ag+、Au+与乙硫醇的反应还生成了 (CH3 CH2 SH) +n ,由此推测Cu+、Ag+、Au+与乙硫醇团簇的反应存在两种通道 ,一种通道是生成M+(CH3 CH2 SH) n,另一种是生成 (CH3 CH2 SH) +n 。Cu+、Au+与乙硫醇的反应还生成了M+(H2 S) (M =Cu、Au) ,但是实验中没有观察到Ag+(H2 S) ,理论计算表明Ag+(H2 S)很不稳定。另外 ,分析产物离子M+(CH3 CH2 SH) n 的强度发现 ,n =1～ 2之间存在明显的强度突变现象     

Cu+、Ag+、Au+与乙硫醇的气相化学反应

利用激光溅射-分子束的技术,结合反射飞行时间质谱计,研究了Cu+、Ag+、Au+与乙硫醇的气相化学反应.结果显示这三种金属离子与(CH3CH2SH)n反应形成一系列团簇离子M+(CH3CH2SH)n,且团簇离子尺寸不一样.Ag+、Au+与乙硫醇的反应还生成了(CH3CH2SH)+n,由此推测Cu+、Ag+、Au+与乙硫醇团簇的反应存在两种通道,一种通道是生成M+(CH3CH2SH)n,另一种是生成(CH3CH2SH)+n.Cu+、Au+与乙硫醇的反应还生成了M+(H2S)(M=Cu、Au),但是实验中没有观察到Ag+(H2S),理论计算表明Ag+(H2S)很不稳定.另外,分析产物离子M+(CH3CH2SH)n的强度发现,n=1～2之间存在明显的强度突变现象.     

First direct evidence of a solid state charge transfer redox system Cu+2 + Mn3+ ⇋ Cu1+ + Mn4+in copper manganese oxide

First direct experimental evidence of the redox system Cu²⁺ + Mn⁺³ ⇋ Cu¹⁺ + Mn⁴⁺ in oxidation catalysts, “Hopcalite”, is presented. The evidence is obtained from chemical shifts and shake-up satellite structure of Cu 2p, and from multiplet splitting of Mn 3s x-ray photoelectron signals.     

K+-Na+和Ag+-Na+两步离子交换技术制作玻璃基光波导研究

利用K+-Na+和Ag+-Na+两步离子交换得到掩埋型光波导.该方法抑制Ag+-Na+离子交换时产生的Ag+微粒,降低波导损耗,增加波导截面的圆对称性,从而提高光波导器件的性能.用该方法制作了1×8光功分器,其插入损耗平均为10.9 dB.