Near-Infrared Spectrum (3000-10 000 cm) of 4-Chlorophenol in Solution

The near-infrared spectra (3000-10 000 cm⁻¹) of 4-chlorophenol-OH and 4-chlorophenol-OD are studied at room temperature in carbon tetrachloride. Some data are also reported for 4-bromophenol-OH and 4-bromophenol-OD. The observed absorptions are assigned to overtones or combinations involving the fundamental transitions which have been recently calculated at the B3LYP/6-311++G(df,pd) level (J. Phys. Chem. A104, 11 685 (2000)). The anharmonicities and the harmonic frequencies of the local ν(OH) and ν(CH) modes and the coupling constants for the binary or ternary combinations are obtained. The extinction coefficients of these transitions are discussed. The half-band width of the ν(OH) and ν(CH) vibrations increases with the absorption frequencies. The experimental harmonic frequencies are obtained from the anharmonicity constants. Comparison with the theoretical frequencies indicates that the low scaling factors ranging from 0.950 to 0.960 characterizing the ν(OH) and ν(CH) vibrations can be accounted for by the large anharmonicity of these vibrations. For these vibrations, the ratio of the experimental harmonic frequencies to the computed frequencies is 0.993. This value does not significantly differ from the average scaling factors of 0.987-0.989 obtained for all the other vibrational modes.     

Identification of hot band transitions of CH4 near 3000 cm

Rovibrational transitions between vibrationally excited states of ¹²CH₄ in the 3.4 μm wavelength region are investigated by a pump-probe technique using an optical parametric oscillator as a pump and a tunable diode laser as a probe. Methane molecules are excited into selected levels of the 2ν₃ state of the tetradecad and numerous transitions between pentad and tetradecad, and between tetradecad and triacontad, have been observed in this spectral range. Positions and assignments of transitions involving a level of the 2ν₃ (F₂) substate are reported. Reliable energy values for 2ν₃ (F₂) levels up to J = 6 are obtained, and the energies and assignments of a number of 3ν₃ levels have been deduced allowing identification of IR lines in the 1.1 μm region.     

The Nature of the 1600 cm−1 Band of Carbons

Abstract

Since what appears to be the first infrared (IR) observation of a char by Kmetko in 1951,¹ IR spectra of coals, chars and various carbon materials have been invariably shown to have a more or less intense band near 1600 cm^?1. A variety of suggestions has been made concerning the cause of the band but the assignments have been in dispute and remained controversial for thirty years.     

Perpendicular bands of cyclopropane in the 3000 cm−1 region

The ν₈ and ν₂ + ν₉ bands of cyclopropane when studied with high resolution exhibit Q-branches at the band centers. The ζ constants calculated using these measured band spacings are +0.12 for ν₈ and +0.07 for ν₂ + ν₉.     

光谱探测中的超宽带减反射膜

设计并研制了基于声光晶体的1 300~3 400nm波段超宽带减反射膜.运用电子束真空沉积系统,采用双材料共蒸发技术,解决了膜系设计时所需材料的折射率匹配和相应波段膜层吸收的问题,吸收在工作波段减少到0.7%.在共蒸发过程中,先沉积蒸发速率不稳定的材料,待蒸发速率稳定后,同时沉积另一种蒸发速率较稳定的材料,可提高共蒸发时两种材料的质量配比准确度从而获得所需要的折射率.制备的薄膜在所需波段平均透射率大于96%,薄膜满足相应的环境检测要求.     

Heterodyne frequency measurements on carbonyl sulfide near 1050 cm

Heterodyne techniques have been used to measure the frequency differences between carbonyl sulfide (OCS) absorption lines and CO₂ laser transitions. A tunable diode laser was used both to scan the OCS absorption spectrum and to provide a beat signal against a CO₂ laser. Frequency differences as great as 8.6 GHz were measured. Many different OCS hot-band transitions were measured near 1050 cm⁻¹, and the measurements on the 02⁰0-00⁰0 band have been extended to such high J levels (J′ = 86) that higher-order centrifugal distortion terms are needed to fit the data.     

The High-Resolution Raman Spectrum of the nu4 Band of Diborane

The high-resolution Raman spectra of the nu4 bands of 11B2H6 and 11B10BH6 have been recorded and analyzed. The recordings have been made using a high-resolution spectrometer based on the inverse Raman effect. Q branches have been observed, but P and R branches were too weak to be seen, and simulations of the observed band contour have been necessary to complete the analysis. A weak Coriolis resonance with the 2nu10 level is present in the 11B2H6 spectrum. The band centers obtained are 790.9829(12) and 804.76985(27) cm-1 for 11B2H6 and 10B11BH6, respectively (uncertainties are type A with a coverage factor k = 1, i.e., 1 standard deviation). Copyright 1999 Academic Press.     

High Resolution Study of Deuterated Hydrogen Sulfide in the Region 2400-3000 cm

High resolution Fourier transform spectra of deuterated hydrogen sulfide have been recorded in the region 2400-3000 cm⁻¹. Rotational structures of the ν₁ + ν₂, ν₂ + ν₃ bands of D₂³²S, of the ν₃ and ν₁ + ν₂ bands of HD³²S, and of the ν₁ + ν₂ band of HD³⁴S were analyzed. Band centers and rotational, centrifugal distortion, and resonance parameters were obtained, which reproduce the initial values of the upper energy levels within a mean accuracy of 1.39 × 10⁻⁴ cm⁻¹ for the states (110) and (011) of D₂³²S, 1.61 × 10⁻⁴ cm⁻¹ and 1.82 × 10⁻⁴ cm⁻¹ for the states (001) and (110) of HD³²S, and 2.09 × 10⁻⁴ cm⁻¹ for the state (110) of HD³⁴S, respectively.     

The High-Resolution FTIR Spectrum of the nu(1) Band of DOBr

Fourier transform infrared spectra of the nu(1) bands of DO(79)Br and DO(81)Br have been recorded with a resolution of 0.0055 cm(-1) in the frequency range of 2510-2800 cm(-1). A total of 1901 lines of the A/B hybrid-type bands of both isotopic species have been assigned and fitted to upper state rovibrational constants employing a Watson's S-reduced Hamiltonian up to sextic terms. The K(a) >/= 4 subband transitions were found to be perturbed and were not included in the fit. The unperturbed band centers for nu(1) of DO(79)Br and DO(81)Br are 2668.79211 +/- 0.00006 and 2668.78842 +/- 0.00005 cm(-1), respectively. The ratio of the vibrational dipole transition moments (μ(a):μ(b)) was found to be 1.30 +/- 0.04 for the band. Copyright 2000 Academic Press.     

Dilepton Spectrum from An Expanding Hot Nuclear Matter

In this paper the dilepton spectrum from an expanding hot nuclear matter is studied.Comparing with the spectrum from hot quark matter,we find that they are quite different.Especially the former with respect to the initial temperature or particle density is monotonic,the latter is non-monotonic.This may serve as theoretical examination for the production of quark phase transition.     

248 Cm和252Cf自发裂变瞬发中子谱测量

在飞行时间方法测量 2 0 0keV— 1 2MeV能区内2 48Cm和2 5 2 Cf自发裂变瞬发中子谱 ,以国际原子能机构推荐的2 5 2 Cf自发裂变瞬发中子谱为标准 ,可以免去探测器效率刻度的问题并消除系统误差 ,提高测量精度 .实验用一个微型电离室作为裂变碎片探测器 ,两个芪晶体中子探测器测量中子及一套基于微机的距离分别为 3 2 ,50和 1 0 0cm ,经过对数据的处理和分析给出了 2 0 0keV— 1 2MeV的中子能区内的实验数据 .用Maxwell分布对实验数据进行拟合 ,得到的核温度为 (1 4 0 1± 0 0 0 6)MeV .     

High Temperature Spectrum for v3 Band of Carbon Dioxide

The total internal partition sums （TIPS） are calculated at the temperature up to 6000 K for 12 C16 02. Using the calculated partition functions, we produce the line intensities of v3 band of 12C1602 at several high temperatures. The results show that the calculated line intensities are in very good agreement with those of HITRAN database at the temperature up to 3000 K, which provides a strong support for the calculations of TIPS and line intensities at high temperature. Then the calculation is extended to further high temperature, and the simulated spectra of u3 band of 12C1602 at 5000 and 6000 K are reported.     

Infrared spectra of CH3Br: The 2ν2 band near 2600 cm−1

The rotational fine structure of 2ν₂ has been studied under high resolution (0.03 cm^?1) for CH₃⁷⁹Br and CH₃⁸¹Br. About 700 lines have been assigned for each isotopic species. The band centers have been found at 2596.871 and 2596.815 cm^?1, respectively.     

Hot band spectroscopy of DCBr near 0.96 μm

High resolution measurements of the 2⁰ ₂ (bending) hot band of the ùA′ band system of deuterobromomethylene between 10 290cm^?1 and 10 540cm^?1 are described. The spectra were recorded by direct absorption of a continuous-wave frequency-modulated external cavity diode laser following pulsed ultraviolet laser photolysis of deuterated bromoform. Although the bending vibrational spacings in the ùA′ state are not regular, the rotational structure in its (020) level was found to be unperturbed at the accuracy of the experimental measurements. This observation provides strong evidence that the position of the excited triplet ó A″, state lies to higher energy, at least 1637cm^?1 above the zero point level of the ground state.     

N2Broadening in theCO 2–0 Band around 4167 cm

N₂broadening coefficients have been measured for 65 lines of the¹³C¹⁶O 2–0 band using a Fourier transform spectrometer. These lines are located in the spectral range 4011–4252 cm⁻¹. The spectra were recorded with 99% isotopically pure¹³CO in a White-type cell at a resolution of 0.005 cm⁻¹. Voigt profiles convolved with the FTS apparatus function were fitted to the experimental lineshapes using a nonlinear least-squares fit technique. From the fits the Lorentzian HWHM was determined as function of N₂pressure. Pressure broadening coefficients formbetween −33 and +34 were obtained with uncertainties of 5.8%. The results are compared to earlier published N₂broadening coefficients and our measurements in the 2–0 band of¹²C¹⁶O. To our knowledge this is the first investigation of¹³CO pressure broadening.     

The near infrared overtone spectrum of propyne taken by diode laser in the 12700 cm−1region

Detailed regions of the near infrared spectrum of propyne between 12737 cm-¹ and 12778cm-¹ have been measured using a simple and inexpensive home-made laser diode spectrometer. This part of the spectrum covers the overlapping 3v₁ + v₃ + v₅ and 3v₁ + v₃ + v₅ + v₁₀—v₁₀ bands. Combining a global fit and an individual profile analysis made possible the determination of the vibrational and rotational constants in each band and in some cases the resolution of the individual K structure in each transition cluster.     

The d(7Li,p)8Li cross section near E cm = 0.61 MeV

The absolute cross section σ of the d(⁷Li, p)⁸Li reaction near the E_cm = 0.61 MeV resonance has been measured using a ⁷Li ion beam and a windowless gas target system filled with D₂ gas. The proton yield of the reaction and the β-delayed α-activity of the residual nuclides ⁸Li were observed both concurrently with the elastic scattering yield, relating σ to the Rutherford scattering cross section σ_R. The resulting values, σ (from p) = 143.6 ± 8.9 mb and σ (from ⁸Li) = 151 ± 20 mb, lead to a weighted mean value of σ = 153 ± 6 mb (χ² = 2.26) including all available values and σ = 146 ± 5 mb (χ² = 0.05) removing some values from the data set. The consequences for the expected flux of high-energy solar neutrinos are discussed.     

High-Resolution Infrared Spectrum of H3SiI in the ν1/ν4Region near 2200 cm

The Fourier transform infrared spectrum of H₃SiI has been recorded in the ν₁/ν₄region from 2075 to 2315 cm⁻¹at an optical resolution of 2.3 × 10⁻³cm⁻¹. The ν₁/ν₄fundamental bands and the (ν₁+ ν₃) − ν₃/(ν₄+ ν₃) − ν₃hot bands have been rotationally investigated. Numerous local perturbations have been observed in the ν₁and ν₄bands and in the hot bands. Without the lines involved in perturbations, more than 2900 transitions of the ν₁/ν₄bands were used to determine the band origins and the vibration–rotation parameters of the ν₁= 1 and νv₄= 1 states. A least-squares fit of 766 apparently unperturbed transitions of the hot bands gave the parameters of the ν₁= ν₃= 1 and ν₄= ν₃= 1 states. Thel(2, 2) resonance in ν₄and theA₁–E Coriolis coupling between ν₁and ν₄have been investigated. Most of the local perturbations have been studied individually using a simple model by which the main perturber for each resonance was identified.