Photodissociation Efficiency Spectroscopy Study of the Rydberg Excited Ion-Pair States of Carbon Dioxide

Photodissociation efficiency spectrum of anionic oxygen atom produced via ion-pair dissociations of carbon dioxide is recorded by means of the synchrotron radiation excitation （XUV photon energy 17.40-20.00eV）. The present spectrum is assigned as the Rydberg-like excited ion-pair states, i.e., Tanaka-Ogawa and Henning series, -↑C^2∑g^＋ （CO2^＋） vibrational ground-state and excitation series. Three Rydberg series, npσu, npπu, and nfu, converging to -↑C^2∑g^＋ （0, 0, 0）, show the higher cross sections.     

激发态RbHe(Ar)分子的光离解

本文研究了Rb（5^2P) He(Ar) nhv→Rb(7^2D) He(Ar) n-1)hv过程，激光频率调离Rb7D5/2→5P3/2跃迁谱线20－100cm^-1，测量了精细结构普线强度分支出I（7D3／2→5P1／2）／I（7D5／2→5P3／2）。测量结果表明，原相互作用势和非绝热效应在分子离解动力学中起关键作用。     

锂分子里德堡态和双激发态的重新分类

根据里德堡轨道的类氢nλ特性 ,对 7Li2 实验已观测到的和理论计算给出的 6 8个电子态进行了分类 ,把这些态划分为核实贯穿里德堡态和核实非贯穿里德堡态 .讨论了双电子激发态和里德堡态的微扰 ,也讨论了这种分类的意义     

Millimeter-Wave Spectroscopy of HCCCP in Excited Vibrational States

The rotational spectra of the unstable HCCCP molecule have been investigated in the millimeter-wave region for the main excited vibrational states which lie below 1000 cm(-1), namely nu(4) (C&bond;C stretch), nu(5) (HCC bend), nu(6) (CCC bend), nu(7) (CCP bend), 2nu(6), 2nu(7), 3nu(7), 4nu(7), nu(5) + nu(7), and nu(6) + nu(7). l-type resonance effects have been taken into account in the analysis of the spectra, so that the values of the anharmonicity constants x(L(66)), x(L(77)), x(L(57)), and x(L(67)) could be determined. The anharmonic interactions which couple the nu(4) state with nu(6) + nu(7), 2nu(6), and 4nu(7) have been also considered, yielding the unperturbed value of the alpha(4) vibration-rotation coupling constant. Copyright 2001 Academic Press.     

二氧化钚分子激发态结构的外场效应

在相对论有效原子实势近似下,用B3LYP密度泛函方法计算优化得到分子轴方向不同电偶极场(-0.005~0.005 a.u.)作用下,二氧化钚的基态几何结构、电偶极矩和分子总能量.在优化构型下,用同样的基组,采用含时密度泛函(TDDFT)方法(TD-B3LYP),研究同样外电场条件下,对二氧化钚的激发能的影响.计算结果表明,在外场作用下,对PuO₂的前5个激发态电子跃迁光谱属于可见-红外-远红外光谱,波长为501.47~10291.5 nm,这是钚原子的奇异特征;激发能与外电场的关系近似满足Grozema等人提出的关系.     

Br2分子里德堡态的高分辨转动谱研究

用窄线宽（０．０８ｃｍ＾－＾１）脉冲可调谐紫外激光和（２＋１）多光子电离方法测量了Ｂｒ２的里德堡（Ｒｙｄｂｅｒｇ）态光谱,在７００００－７１５００ｃｍ＾－＾１范围内,获得了溴分子［П３／２］４ｄ振动系列,测量（ｖ＇,ｖ”）＝（１,０）,（２,０）的高分辨振转谱,得到其转动常数Ｂ’７９－８１分别为０．０８８３２和０．０８８０５ｃｍ＾－＾１,并提出此系列的角动量量子数Ω应为１。     

Resonance-Enhanced Photon Excitation Spectroscopy of the Even-Parity Autoionizing Rydberg States of Xe

用脉冲直流放电产生Xe原子亚稳态5p56s[3/2]2和5p56s′[1/2]0.在单光子28000－42000cm-1能量范围内,结合飞行时间质谱技术获得Xe原子共振增强激发光谱.光谱分析表明,所有谱线来源于Xe原子5p56s[3/2]2和5p56s′[1/2]0两个亚稳态吸收单个光子向偶宇称np′、nf′自电离Rydberg态序列的跃迁.实验观测到许多新的自电离能级,并获得更精确和系统的能级位置和量子亏损值数据.     

Study of the Heterocyclic-Substituted Platinum-1,2-Enedithiolate 3ILCT Excited States by Transient Absorption Spectroscopy

The photoluminescent 1,2-enedithiolate complexes, (dppe)Pt{S₂C₂(2-quinoxaline)(H)}, [L₂Pt{S₂C₂(2-pyridinium)(H)}]⁺ where L₂ = dppm and dppe, [L₂Pt{S₂C₂(4-pyridinium)(H)}]⁺, [L₂Pt{₂C₂(N-Methyl-4-pyridinium)(H)}]⁺ and [L₂Pt{S₂C₂(CH₂CH₂-N-2-pyridinium)}]⁺ where L₂ = dppm, dppe, and dppp are room temperature dual emitters where the emissions have thiolate to heterocycle * intraligand charge transfer character (ILCT) singlet and triplet character. The pyridinium complexes have strong triplet-triplet absorption bands at approximately 400, 520 and 630 nm with a weaker band at 800 nm while (dppe)Pt{S₂C₂(2-quinoxaline)(H)} has strong triplet-triplet absorption bands at 385 and 550 nm with weaker bands at 610 and 805 nm. By fitting the decay of the transients to single exponential kinetics, the ³ILCT* lifetimes of the pyridinium complexes where determined to be 0.7 to 15.9 s (DMSO) while the ₃ILCT* lifetime of (dppe)Pt{S₂C₂(2-quinoxaline)(H)} was determined to be 2.8 s (CH₃CN). The transient absorption spectra of the complexes is affected by the appended heterocycle rather than the bulk of ancillary phosphine ligand or whether the heterocycle is protonated or alkylated.     

水分子F态超快动力学：时间分辨光电子能谱研究

本文利用双光子激发和时间分辨的光电子成像技术研究了水分子■态的超快动力学.这是首次对水分子■态进行时间分辨的实验研究.水(重水)分子■和■态的寿命分别为1.0±0.3(1.9±0.4)和10±3(30±10)皮秒.我们提出■态主要通过非绝热耦合内转换到■态,而■态通过科里奥利相互作用耦合到■态.     

Two-Photon Excited State Dynamics of Dark Rydberg and Bright Valence States in Furan

Two-photon absorption in systems with parity permits access to states that cannot be directly prepared by onephoton absorption. Here we investigate ultrafast internal conversion(IC) dynamics of furan by using this strategy in combination with femtosecond time-resolved photoelectron imaging. The dark Rydberg S_1 and bright valence S_2 states are simultaneously excited by two photons of 405 nm, and then ionized by two photons of 800 nm. The IC from S_2 to S_1 is clearly observed and extracted from the time dependence of the higher photoelectron kinetic energy(PKE) component. More importantly, the internal conversions to hot S_0 from directly-prepared S_1 and secondarily-populated S_1 are unambiguously identified by the time-dependence of the lower PKE component.The average lifetime of the S_2 and S_1 states is measured to be 29 fs. The internal conversions of S_2 to S_1, S_1 to hot S_0 occur on estimated timescales of 15.4 fs and 38 fs, respectively.     

141Nd激发态的在束γ谱学研究

通过130Te(16O,5nγ)141Nd反应布居了141Nd的高自旋态能级. 对反应产生的在束γ射线进行了γ射线单谱和γ-γ符合测量. 建立了激发能达7614.5keV的141Nd能级纲图,新发现了12条γ射线和15个能级. 基于实验测量的γ跃迁各向异性,建议了141Nd部分能级的自旋值. 用一个h11/2价中子空穴与142Nd核芯晕态的耦合可以定性地解释141Nd的能级结构.     

Emission Properties of Laser Plasma Excited on Molecular-Cluster Carbon Dioxide Jets

Technical Physics - We report on the results of investigation of a gas-jet laser-plasma source of extreme ultraviolet radiation based on a conical supersonic nozzle. As a target, we used...     

Dielectric Spectroscopy of Strongly Correlated Electronic States of Vanadium Dioxide

The thermal evolution of the conductivity of a VO₂ film and database-obtained band gap E_g of film nanocrystallites is traced in the temperature range of –196°C < T < 100°C (77 K < T < 273 K); the level position of donor impurity centers is determined to be E_d = 0.04 eV. It is shown that energy E_g decreases from 0.8 to ～0 eV with an increase in temperature in the range of 273 K < T < 300 K, which is caused by the narrowing of the energy gap due to correlation effects and considered as the temperature-extended Mott “insulator–metal” electron phase transition with the monoclinic lattice symmetry retained. The subsequent jump in the symmetry from monoclinic to tetragonal with a further increase in temperature is considered as the Peierls structural phase transition, the temperature of which is in the vicinity of 340 K and determined by the size effects, nonstoichiometry of VO₂ film nanocrystallites, and degree of their adhesion to the substrate.     

激发态铷分子的光离解

研究了Rb(52P3/2)+Rb(5S)+nhν→Rb(72DJ)+Rb(5S)+(n-1)hν过程, 激光频率ν调到Rb7D3/2→5P3/2跃迁谱线的两翼20-100 cm-1, 测量了精细结构谱线强度分支比I(7D3/2→5P1/2)/I(7D5/2→5P3/2). 实验表明, 原子相互作用势和非绝热效应在离解动力学中起关键作用.     

水分子高激发态的绝热势能面与光解机制

本文在从头算icMRCI+Q水平上,发展了水分子的基态和九个激发态?、?、B、C、D、D''、D''、?''和F的全维绝热势能面. 势能面的拟合采用了高斯过程回归并结合置换不变多项式方法. 通过选择大的活动空间与添加额外弥散函数的基组来准确描述这些里德堡状态,计算得到的垂直激发能和平衡构型与先前的理论与实验值十分吻合. 相对于前三个被广泛研究的低能量电子态,对高激发态光解的理论与实验研究仍然十分有限. 本文研究了水在真空紫外光解过程中涉及到的高激发态的全部三个解离通道. 特别是基于新发展的势能面,首次清晰地阐明了D-E''、E''-F、?-?和?-C电子态之间的锥形交叉等信息,文中详细讨论了这些电子激发态的非绝热解离途径,为阐明这些高里德堡态的光解离机制提供了帮助.     

Sr原子高激发态光谱的研究

采用三台染料激光器分步激发Ｓｒ原子，利用自电离过程产生离子或电子。当固定第一和第三步激光发光之波长而扫描第二步激发光之波长时，便可获得Ｓｒ原子５ｓｎｓ＾１Ｓ０和５ｓｎｄ１，３Ｄ２系列的光谱。用多通道量子数亏损理论分析和描述实验光谱，不仅成功地证实了预测了已测和未测实验能级及其波函数，而且能够给出这些高激发态的自发辐射寿命。     

红外光谱法测定精四氯化钛中二氧化碳的含量（英文）

精TiCl_4是海绵钛生产的关键环节,且海绵钛中杂质碳和氧(C,O)与精TiCl_4中杂质C和O含量成4倍富集关系,因此,钛材质量控制的关键是控制精TiCl_4中杂质C和O的含量。为了控制精TiCl_4中的C和O,需要分析C和O杂质的来源,对精TiCl_4中杂质进行严格控制。测定精TiCl_4中CO2的含量,对精TiCl_4中杂质C和O的分析具有重要意义。CO_2具有红外吸收谱线,因而能够利用红外光谱实现测定,然而精TiCl_4与空气中水气接触极易发生水解反应,生成强腐蚀性的盐酸烟雾,不能使用常规的红外吸收池进行测定。根据Lambert-Beer定律,被测组分浓度(c_x)与吸光度(A)~样品光程(L)曲线的斜率成正比,本研究利用波数范围7 800~440 cm~(-1)的硒化锌窗片(φ10 mm×1 mm)和玻璃池体(42,22,12,7和4 mm光程)组装成一套红外吸收池,采用加标法测定精TiCl_4中CO_2杂质含量。实验得出CO_2的检出限为0.92 mg·kg~(-1),样品回归方程Y=0.031 1X,相关系数r为0.997 2,加标CO_2样品的回归方程Y=0.131 7X,相关系数r为0.998 6,线性关系较好,测定精TiCl_4中CO_2含量为1.53 mg·kg~(-1),标准偏差(SD)为0.04 mg·kg~(-1),方法相对标准偏差(RSD)在0.53%~1.27%之间,加标回收率在89.2%~96.8%。此红外吸收池安全简便、容易拆洗、可重复使用,通过一次加标样品定量分析精TiCl_4中CO_2含量,可满足精TiCl_4中CO_2分析的要求。     

139Ce的多准粒子激发态

利用能量为50MeV的¹²C束流, 通过反应¹³⁰Te(¹²C,3n)布居了¹³⁹Ce的高自旋态. 基于标准在束核谱学实验测量结果, 扩展并更新了¹³⁹Ce的能级纲图. ¹³⁹Ce的能级结构具有球形原子核的典型特征, 其高自旋态由单粒子激发形成. 利用经验壳模型计算了¹³⁹Ce的多准粒子激发态能量, 研究了其高自旋激发态的多准粒子特性.