نتایج جستجو برای: spectroscopic constants
تعداد نتایج: 88973 فیلتر نتایج به سال:
The spectroscopic methods UV-Vis absorption, FT-IR and (13)C and (19)F NMR demonstrate that 1,2-diiodoperfluoroethane (DIPFE) and 1,6-diiodoperfluorohexane (DIPFH) display strong halogen bonding with halide anions. A 1 : 1 stoichiometry of DIPFE or DIPFH with halide anion is confirmed, and the bonding constants and molar extinction coefficients are obtained. With the same halide, DIPFH possesse...
Potential energy surfaces for the ground and excited electronic states responsible for the Hartley continuum of ozone are used to obtain quadratic, cubic, and quartic force constants. Vibrational dependence of rotational constants to sixth order is calculated by perturbation theory. The spectroscopic constants enable computation of rovibronic energy levels. Overlap of ground state and excited s...
DFT and RHF level calculations in conjunction with three different of basis sets have been used to investigate the variations in the bond lengths, dipole moment and rotational constants, IR frequencies, IR intensities and rotational invariants of ClCCCN. The nuclear quadrupole constants of chlorine and nitrogen of ClCCCN have been calculated on the experimental rs structure as well as on the B3...
A detailed analysis of the high-resolution infrared emission spectra of gaseous HgH2 and HgD2 in the 1200-2200 cm(-1) spectral range is presented. The nu3 antisymmetric stretching fundamental bands of 204HgH2, 202HgH2, 201HgH2, 200HgH2, 199HgH2, 198HgH2, 204HgD2, 202HgD2, 201HgD2, 200HgD2, 199HgD2, and 198HgD2, as well as a few hot bands involving nu1, nu2, and nu3 were analyzed rotationally, a...
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the binding behavior of a competitive inhibitor, n-phenylbenzhydroxamic acid (bha) against horseradish peroxidase (hrp) was studied in order to understand and predict the interaction mechanism of hydrogen donors with the enzyme. the dissociation constants of the complexes of hrp-bha, hrp-donor and hrp-bha-azide were estimated at specified conditions by difference spectroscopy. the binding site ...
The optical constants of GaeslInu4sP have been determined from 0.8 to 5.0 eV using variable-angle spectroscopic ellipsometry measurements at room temperature. The metal-organic vapor-phase-epitaxy-grown samples were x-ray analyzed to confirm lattice matching to the GaAs substrate. The effects of the native oxide were numerically removed from the data to determine the intrinsic optical constants...
Optical constants and roughness study of dc magnetron sputtered iridium films" (2002). Faculty Publications from the Department of Electrical and Computer Engineering. 5. Extremely smooth thin films of iridium have been deposited onto superpolished fused silica substrates using dc magnetron sputtering in an argon plasma. The influence of deposition process parameters on film microroughness has ...
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