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The reactions of 4-carboxy-1,2-cyclohexanedionedioxime and nickel(II) were studied in alkaline media. Spectrophotometric studies indicate the presence of a 1:1 complex ion, NiD-. Magnetic susceptibility measurements on a series of solutions of varying ratios of vic-dioxime and nickel(II) showed that the 1:1 complex ion was diamagnetic and that two paramagnetic complexes, probably NiD24- and NiD37-, are present in solution. The stability constants for the three complexes were calculated from spectrophotometric and magnetic susceptibility data. The log K values were found to be log K1 = 28.74 ± 0.60, log K2 = 0.76 ± 0.15, and log K3 = 3.67 ± 0.73, respectively. 相似文献
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E.H. Appelman B. Beagley D.W.J. Cruickshank A. Foord S. Rustad V. Ulbrecht 《Journal of Molecular Structure》1976,35(1):139-148
The molecular structure of FBrO3 has been studied by gas-phase electron diffraction. Least-squares refinements of the molecular geometry using fixed spectroscopic amplitudes revealed two geometrical minima. Initially, the amplitudes employed were derived from diagonal force fields obtained by spectroscopic least-squares refinements to fit observed and calculated wave numbers; for each geometry there are two spectroscopic minima. In the lowest geometrical minimum the wave number agreement is poor, however, the introduction of the ∠OBrO/∠FBrO interaction force constant removed the discrepancies; the resulting force field is F(Br-O) = 6.92 ± 0.02 mdyn Å?1F(Br-F) = 3.22 ± 0.03 mdyn Å?1, F(∠OBrO) = 1.06 ± 0.02 mdyn Å, F(∠FBrO) = 0.81 ± 0.03 mdyn Å, F(∠OBrO/∠FBrO) = ?0.19 ± 0.02 mdyn Å. In the corresponding geometrical minimum rg(Br-O) = 1.582 ± 0.001 Å, rg(Br-F) = 1.708 ± 0.003 Å, rα(∠OBrO) = 114.9 ± 0.3°, rα(∠FBrO) = 103.3 ± 0.3°. Perpendicular amplitude correction coefficients, calculated for each force field employed, were used throughout to relate the interatomic distances through the rα-structure. The geometries of the rαo- and re-structures are estimated. 相似文献
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Ab initio calculations are presented for H2 and D2 relative Raman intensities originating from common rotational levels for both vibrational-rotational and pure rotational transitions. Factors f(J) required to correct measured intensities for molecular non-rigidity (e.g. in temperature measurements) are tabulated. The calculations are compared with literature perturbation-theory equations (significant differences at large J in vibration-rotation) and with experiment. 相似文献
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Catherine Westfall 《Physics in Perspective (PIP)》2006,8(2):189-213
I explore the fifty-year development of M?ssbauer spectroscopy by focusing on three episodes in its development at Argonne
National Laboratory: work by nuclear physicists using radioactive sources in the early 1960s, work by solid-state physicists
using radioactive resources from the mid- 1960s through the 1970s,and work by solid-state physicists using the Advanced Photon
Source from the 1980s to 2005. These episodes show how knowledge about the properties of matter was produced in a national-laboratory
context and highlights the web of connections that allow nationallaboratory scientists working at a variety of scales to produce
both technological and scientific innovations. 相似文献
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Detailed quasiclassical and time-independent quantum reaction probabilities are given for a surface on which large discrepancies between quasiclassical and wavepacket results have previously been found. The quasiclassical results are shown to agree relatively reasonably with the oscillation-averaged time-independent quantum ones if the quasiclassical reverse probabilities are chosen in the threshold region. 相似文献
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