混晶（Rb_xK_（1－x））_2SnCl_6的相变研究

用非极性喇曼散射光谱研究了混晶（Ｒｂ_ｘＫ_（１－ｘ））_２ＳｎＣｌ_６性质随组份（０＜ｘ＜１）及温度（１０Ｋ＜Ｔ＜３００Ｋ）的变化。发现在纯Ｋ_２ＳｎＣｌ_６晶体中用Ｒｂ￣＋部分替代Ｋ￣＋后，将降低原Ｋ_２ＳｎＣｌ_６的相变温度Ｔｃｌ。当混晶中Ｒｂ￣＋成份超过极限浓度（ｘ＞０．７）后，该相变就被抑制。不同组份样品的同一喇曼模频率，随Ｒｂ￣＋的增加，向低频方向移动。用平均力常数拟合给出很好的理论解释。     

半磁半导体Zn_（1－x）Mn_xS中的能量传递

本文测量了Ｚｎ１－ｘＭｎｘＳ在不同Ｍｎ浓度（０．００１＜ｘ＜０．５）下的发射谱和衰减曲线，并且用Ｙｏｋｏｔａ和Ｔａｎｉｍｏｔｏ模型进行了分析在对４Ｔ１衰减曲线进行拟合时发现衰减曲线是两种不同弛豫过程之和：（１）孤立的Ｍｎ２－离子的４Ｔ１衰减，它确定衰减曲线的尾部，有较长的衰减寿命；（２）Ｍｎ２－离子聚集体（例如Ｍｎ２－离子对）的４Ｔ１衰减，这种衰减比单个Ｍｎ２－离子的衰减更快．我们深入分析了在ｘ＝０．０６２，Ｔ＝８０Ｋ时的Ｚｎ１－ｘＭｎｘＳ的发射谱及其衰减曲线，得到两个衰减寿命：τ１＝７０μｓ，τ２＞１０００μｓ，这表明在高Ｍｎ浓度时存在着两个弛豫过程：一个是较快的，另一个则是较慢的，根据Ｇｏｅｄｅ等人的实验结果可以断定较慢的过程来自孤立的Ｍｎ２－离子，那么便可以判知较快的过程是来源于Ｍｎ２－离子对．正是高Ｍｎ浓度下的Ｚｎ１－ｘＭｎｘＳ中存在着Ｍｎ２＋－Ｍｎ２＋离子对，在其间有能量迁移以及它和能量受主之间的能量传递造成了该体系中的ＩＲ发射．     

混晶（RbxK1—x）2SnCl6的相变研究

用非极性喇曼散射光谱研究了混晶（ＲｂｘＫ１－ｘ）２ＳｎＣｌ６性质随组份（０〈ｘ〈１）及温度（１０Ｋ〈Ｔ〈３００Ｋ）的变化，发现在纯Ｋ２ＳｎＣｌ６晶体中用Ｒｂ＾＋部分替代Ｋ＾＋后，将降低原Ｋ２ＳｎＣｌ６的相变温度Ｔｃｌ。当混晶中Ｒｂ＾＋成份超过极限浓度（ｘ〉０．７）后，该相变就被抑制，不同组份样品的同一喇曼模频率，随Ｒｂ＾＋的增加，向低频方向移动，用平均力常数拟合给出很好的理论解释。     

脉冲激光淀积Ba_（1－x）K_xBiO_3薄膜

我们用熔融法制备了Ｂａ１－ｘＫｘＢｉＯ３氧化物超导体，其超导转变温度２８．５Ｋ，零电阻温度２５．２Ｋ．以此为靶，用脉冲激光淀积技术，制备了Ｂａ１－ｘＫｘＢｉＯ３超导薄膜，Ｔｃ（ｏｎｓｅｔ）＝２４．５Ｋ，Ｔｃ（Ｒ＝０）＝２０．８Ｋ．     

激光沉积法制备（Y1—xHox）Ba2Cu3O7—δ薄膜

本文报道了用激光沉积法在（１００）ＬａＡｌＯ３衬底上制备（Ｙ１－ｘＨｏｘ）Ｂａ２Ｃｕ３Ｏ７－δ（ｘ＝０，０．２，０．４）超导薄膜．结果表明，新超导薄膜表面光滑，具有很强的ｃ轴织构，零电阻温度Ｔｃ０约９１Ｋ，最佳临界电流密度Ｊｃ为４．７×１０６Ａ／ｃｍ２（７７Ｋ）．     

Gd＿（1－x）Ca＿xBa＿2Cu＿3O＿（7－y）高温超导体压力效应的研究

研究了Ｇｄ＿（１－ｘ）Ｃａ＿ｘＢａ＿２Ｃｕ＿３Ｏ＿（７－ｙ）（０．０≤Ｘ≤０．２０）高温超导体在常压和高压下的超导电性在１－３００Ｋ温度范围内，利用Ｂｒｉｄｇｍａｎ对顶砧获得压力达９．０ＧＰａ，测量了（Ｘ＝０．１０，０．１５，０．２０）样品的ｄＴ＿ｃ／ｄｐ分别为７．６８，７．８和４．４６Ｋ／ＧＰａ。发现Ｔ＿ｃ的压力导数随着ｃａ￣（２＋）含量的增加而下降，分析了氧含量对Ｔ＿ｃ和ｄＴ＿ｃ／ｄＰ的影响．利用常压下晶格参数精修值和阳离子与氧离子间距随压力的改变，说明ＣｕＯ＿２面在超导电性上的作用，用ＣｕＯ＿２面之间耦合解释Ｔ＿ｃ（Ｐ）曲线的非线性关系。     

高Tc超导体YBaCuO（F）：磁性和ESR测量

本研究高Ｔｃ大块超导体ＹＢａ２Ｃｕ３Ｏ７－ｂ（Ｆｘ）（其中ｘ＝０．０，０．５，０．７５，１．０，１．５，２．０，２．５）的磁性。Ｘ射线衍射实验表明相当多的Ｆ进入了ＹＢａＣｕＯ（１２３）晶格并被Ｏ空位俘获。用振动样品磁强计（ＶＳＷ）测试这些样品的质量比磁矩σ与温度Ｔ的关系，以及抗磁性磁滞回线。未掺氟样品的Ｔｃ为８９Ｋ，掺Ｆ（ｘ＝０．７５）的样品具有最高的Ｔｃ０＝９３Ｋ和最强的抗磁性。在１５０Ｋ样品     

Y_（1－x）Pr_xBa_2Cu_3O_（7－δ）超导体正常态异常的正电子湮没

在７７—３００Ｋ温度范围内用正电子湮没方法测量了Ｙ１－ｘＰｒｘＢａ２Ｃｕ３Ｏ７－δ（ｘ＝０．２，０．１，０．０）三个超导样品中正电子湮没寿命随温度的变化，细致地研究了正常志异常现象．Ｘ为０．０和０．１的二个样品分别在较Ｔｃ高４０Ｋ和３０Ｋ处观察到了正常态异常现象ｘ＝０．２样品（Ｔｃ＜８０Ｋ）没有观察到正常态异常现象．实验观察到的正常态异常现象可能是发生超导转变的前奏，由结构不稳定产生的类相交所致．     

粲夸克偶素P波态χ_（c0）宽度测量

利用北京谱仪在北京正负电子对撞机上采集的３５０万（２Ｓ）事例，通过（２Ｓ）→γπ－和γＫ＋Ｋ－反应道测量了Ｘｃ０的总宽度．由ＭｏｎｔｅＣａｒｌｏ模拟给出的质量分辨函数，利用拟合Ｘｃ２谱形得到的质量分辨作标定后，用于Ｘｃ０宽度的拟合，得到Ｘｃ０的宽度为（１５．０）ＭｅＶ．同时定出了ＸｃＪ（Ｊ＝０，２）到π＋π＝和Ｋ＋Ｋ－的衰变分支比．结果为Ｂ（Ｘｃ０→π＋π－）＝（４．２７±０．２３±Ｏ．６０）×１０－３；Ｂ（Ｘｃ０→Ｋ＋Ｋ－）＝（３．４４±０．２１±０．４７×１０－３；Ｂ（Ｘｃ２→π＋π－）＝（１．５２±０．１７±０．２９）×１０－３和Ｂ（Ｘｃ２→Ｋ＋Ｋ－）＝（５．２±１．１±１．８）×１０－４，其中第一项误差为统计误差，第二项为系统误差。     

Bi_（2．2）Sr_（1．8）Ca_（1．05）Cu（2．15－x）NaxO_

本文介绍了用熔融法制备Ｂｉ２．２Ｓｒ１．８Ｃａ１．０５Ｃｕ２．１５－ｘＮａｘＯ８＋ｙ（ｘ＝０，０．４～０．８）样品，发现诸样品零电阻温度都在９０Ｋ左右，其小ｘ＝０．７．Ｔｃ０达到９２，５Ｋ．在８１Ｋ较高温区，该类样品仍然表现出良好的超导电性，其临界电流密度还达到１０３Ａ／ｃｍ２量级．     

Theoretical Study of the Collision-Induced Double Transition CO(2) (nu(3) = 1) + N(2) (nu(1) = 1) <-- CO(2) (nu(3) = 0) + N(2) (nu(1) = 0) at 296 K

A procedure is presented for the calculation of the double vibrational collision-induced absorption CO(2) (nu(3) = 1) + N(2) (nu(1) = 1) <-- CO(2) (nu(3) = 0) + N(2) (nu(1) = 0) on the basis of quantum lineshapes computed using an isotropic potential and dipole-induced dipole functions. The linestrengths and energies of the vibration-rotation transitions are treated explicitly for N(2), utilizing the HITRAN database for CO(2). The theoretical absorption profile is compared to recent experimental results. By narrowing the width of the individual lines contributing to the overall absorption profile relative to their values determined for N(2)-N(2) collision-induced absorption, excellent agreement between theory and experiment is obtained. Copyright 2000 Academic Press.     

First Observation of the nu(17)-nu(4) Difference Bands of Diborane (10)B(2)H(6) and (11)B(2)H(6)

An analysis of the nu(17)-nu(4) difference bands near 800 cm(-1) of two isotopic species, (10)B(2)H(6) and (11)B(2)H(6), of diborane has been carried out using infrared spectra recorded with a resolution of ca. 0.003 cm(-1). In addition, the nu(17) band of (10)B(2)H(6) has been recorded and assigned. Since this band in (11)B(2)H(6) had already been studied (R. L. Sams, T. A. Blake, S. W. Sharpe, J.-M. Flaud, and W. J. Lafferty, J. Mol. Spectrosc. 191, 331-342 (1998)), it was possible to derive precise energy levels and Hamiltonian constants for the 4(1) vibrational states of both isotopic species. Copyright 2000 Academic Press.     

The 2(3)Delta(g) State of (7)Li(2)

Using pulsed perturbation-facilitated optical-optical double resonance (PFOODR) spectroscopy, the 2(3)Delta(g) state of (7)Li(2) (electronic configuration (varsigma(g)2s) (4ddelta(g)), effective principal quantum number n* = 4.101) has been observed and assigned. Molecular constants and a RKR potential energy curve were obtained. The major molecular constants are Copyright 2000 Academic Press.     

The Perturbation between the G(1)Pi(g) and 2(1)Delta(g) States of (7)Li(2)

We have observed the rotational levels in the v = 2, 3, 5, 6, 7, and 8 vibrational manifolds of the 2(1)Delta(g) state of (7)Li(2) via the A(1)Sigma(+)(u) intermediate levels by DeltaLambda = 2 transitions. This violation of the DeltaLambda = 0, +/-1 selection rule is due to the interaction with the G(1)Pi(g) state. Band-by-band deperturbations of the G(1)Pi(g) approximately 2(1)Delta(g) (v(Pi), v(Delta)) = (11, 2), (12, 3), (15, 5), (16, 6), (18, 7), and (19, 8) bands have been performed. Deperturbed molecular constants and rotational-electronic interaction parameters are reported here. Copyright 2000 Academic Press.     

Rovibrational Intensities of the (00(0)3) <-- (10(0)0) Dyad Absorption Bands of (12)C(16)O(2)

Absolute line intensities of (12)C(16)O(2) are experimentally measured for the first time for the (00(0)3)(I) <-- (10(0)0)(II) band at 5687.17 cm(-1) and the (00(0)3)(I) <-- (10(0)0)(I) band at 5584.39 cm(-1). The spectra were obtained using a Bomem DA8 Fourier transform spectrometer and a 25-m base-path White cell at NASA-Ames Research Center. The rotationless bandstrengths at a temperature of 296 K and the Herman-Wallis parameters are S(0)(vib) = 6.68(30) x 10(-25) cm(-1)/(molecule/cm(2)); A(1) = 1.4(9) x 10(-4), and A(2) = -1.1(5) x 10(-5) for the (00(0)3)(I) <-- (10(0)0)(II) band and S(0)(vib) = 6.07(22) x 10(-25) cm(-1)/(molecule/cm(2)); A(1) = 5.2(1.5) x 10(-4) and A(2) = -4.0(7) x 10(-5) for the (00(0)3)(I) <-- (10(0)0)(I) band.     

The v(1)+v(3) Bands of the (16)O(17)O(16)O and (16)O(16)O(17)O Isotopomers of Ozone

Using 0.002 cm(-1) resolution Fourier transform absorption spectra of an (17)O enriched ozone sample, an extensive analysis of the v(1)+v(3) bands of the (16)O(17)O(16)O and (16)O(16)O(17)O isotopomers of ozone has been performed for the first time. The experimental rotational levels of the (101) vibrational states were satisfactorily reproduced using a Hamiltonian matrix that takes into account the observed rovibrational resonances. More precisely, for (16)O(17)O(16)O, as for the other C(2v)-type ozone isotopomers, it was necessary to account for the Coriolis type resonances linking the (101) rotational levels with the levels of the (200) and (002) vibrational states and the Darling-Dennison interaction coupling the levels of (200) with those of (002). For the C(s)-type isotopomer, namely (16)O(16)O(17)O, as for (16)O(16)O(18)O and (16)O(18)O(18)O, it proved necessary to also account for an additional DeltaK(a)&equals+/-2 resonance involving the rotational levels from (101) and (002) (J.-M. Flaud and R. Bacis, Spectrochimica Acta Part A 54, 3-16 (1998)). Using a Hamiltonian matrix which takes these resonances explicitly into account, precise vibrational energies and rotational and coupling constants were deduced, leading to the following band centers: v(0)(v(1)+v(3))=2078.3496 cm(-1) for (16)O(17)O(16)O and v(0)(v(1)+v(3))=2098.8631 cm(-1) for (16)O(16)O(17)O. Copyright 2001 Academic Press.     

CO2同位素分子16O12C16O, 16O12C17O, 16O13C17O配分函数研究

本文主要研究了CO2的三种同位素分子16O12C16O , 16O12C17O ,16O13C17O 70 K~6000 K的总内配分函数 (TIPS)。在总内配分函数的计算中, 转动配分函数的计算采用了McDowell的解析式法, 振动配分函数则采用了简谐振动近似(HOA)获得。最后通过将两配分函数乘积近似计算得出TIPS, 并将其70~3000 K的数据和HITRAN04数据进行了比较, 发现所得结果和数据库符合的较好, 且其误差可以近似看成一条直线。并通过对误差的拟合修订了高温区(3000~6000 K)的计算数据, 给出了在高温下的较为准确的TIPS值。     

Torsional Splitting in the nu(5) Fundamental Infrared Band of CH(3)CD(3) and (13)CH(3)CD(3)

The nu(5) fundamental (C-C stretching) of CH(3)CD(3) shows a resolved torsional structure, caused by perturbations due mainly to the linear dependence of the torsional potential barrier on the normal coordinate Q(5). We were able to analyze this structure and to assign vibration-rotation transition wavenumbers for all five torsional components, classified according to the symmetry species of the G(18)((3)) extended molecular group. The torsional splitting pattern is qualitatively similar to that of a nondegenerate vibrational state with an even number of excited torsional quanta v(6). Explorative calculations show that the main perturber system should consist of the torsional components of the vibrational ground state correlating with v(6)=4 in the high barrier limit. The strength of the perturbation on the E(r0) torsional components of nu(5) increases rapidly with r, the E(40) component being the most affected. The observed transition wavenumbers can be reasonably fitted by a simplified model containing independent effective vibration-rotation parameters for the five different torsional components of nu(5), for both CH(3)CD(3) and (13)CH(3)CD(3). The trend of the determined values of the effective vibrational wavenumbers and rotational parameters over the torsional components supports the proposed vibration-torsion interaction mechanism, responsible for the observed torsional splittings. A strong anomaly observed in the rotational intensity distribution of nu(5) is discussed. Copyright 2001 Academic Press.