Search results for "CH3D"

showing 2 items of 2 documents

Calculated Line Broadening Coefficients in the nu2 Band of CH3D Perturbed by Helium

2003

International audience; Line broadening coefficients have been calculated, at room temperature, for lines in the P and R branches of the nu2 band of monodeuterated methane. A properly symmetrized semiclassical model with parabolic relative trajectories has been used. Two interaction potential models have been considered. The first is a Lennard-Jones type atom-atom potential, while the second one was derived from ab initio calculations. The calculated line widths were compared to the available experimental data and a satisfactory agreement was found, although the model contains no other adjustable parameters than the four atomic Lennard-Jones ones. Nonetheless, failures of calculations have …

PhysicsLine broadening coefficients010304 chemical physicsCondensed matter physics[ PHYS.QPHY ] Physics [physics]/Quantum Physics [quant-ph]Semiclassical physicschemistry.chemical_elementQuantum numberSemiclassical calculations01 natural sciences7. Clean energyAtomic and Molecular Physics and OpticsCH3DInteraction potentialchemistry[PHYS.QPHY]Physics [physics]/Quantum Physics [quant-ph]Ab initio quantum chemistry methods0103 physical sciencesPhysics::Atomic and Molecular ClustersPhysical and Theoretical ChemistryAtomic physics010303 astronomy & astrophysicsSpectroscopyHeliumLine (formation)
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Preliminary analysis of CH3D from 3250 to 3700 cm(-1)

2006

International audience; The infrared spectrum of CH3D from 3250 to 3700 cm(-1) was studied for the first time to assign transitions involving the nu(2) + nu(3), nu(2) + nu(5), nu(2) + nu(6), nu(3) + 2(nu 6) and 3 nu(6) vibrational states. Line positions and intensities were measured at 0.011 cm(-1) resolution using Fourier transform spectra recorded at Kitt Peak with isotopically enriched samples. Some 2852 line positions (involving over 900 upper state levels) and 874 line intensities were reproduced with RMS values of 0.0009 cm(-1) and 4.6%, respectively. The strongest bands were found to be nu(2) + nu(3) at 3499.7 cm(-1) and nu(2) + nu(6) at 3342.5 cm(-1) with integrated strengths, respe…

line intensitieshot bands010504 meteorology & atmospheric sciencesInfraredmonodeuterated methaneFourier transform spectra01 natural sciencesPreliminary analysisRoot mean squaresymbols.namesake0103 physical sciencesline positionsPhysical and Theoretical Chemistry010303 astronomy & astrophysicsSpectroscopydatabase0105 earth and related environmental sciences[PHYS.PHYS.PHYS-AO-PH]Physics [physics]/Physics [physics]/Atmospheric and Oceanic Physics [physics.ao-ph]Physics33.20.EaAtomic and Molecular Physics and OpticsCH3D[ PHYS.PHYS.PHYS-CHEM-PH ] Physics [physics]/Physics [physics]/Chemical Physics [physics.chem-ph][ PHYS.PHYS.PHYS-AO-PH ] Physics [physics]/Physics [physics]/Atmospheric and Oceanic Physics [physics.ao-ph]symbols[PHYS.PHYS.PHYS-CHEM-PH]Physics [physics]/Physics [physics]/Chemical Physics [physics.chem-ph]Atomic physicsGround stateHamiltonian (quantum mechanics)
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