INTERACTION POTENTIALS OF GROUND STATE RARE GAS HALIDES

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1978

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Ohio State University

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The interaction potentials foe the systems F + Ne Kr, Xe and Cl + Xe have been investigated from the measurements of differential scattering cross sections [σ(θ)] at various collision energies by crossing two supersonic atomic beams, F (C1) atoms were produced by thermal dissociation in a resistively heated nickel (graphite) oven using rare gases as carriers. In addition to 2P3/2 ground state, the halogen atom beam contains an appreciable amount of spin-orbit excited state, 2P1/2. From the 2P3/2+1SO(2P1/2+1SO) asymptote emerge 2Π1/2 and 2Π3/2(2Π1/2) states. Data analysis proceeds by assuming an analytic form for the potentials 2Π1/2(X12),2Π3/2(I32),2Π1/2(II12) (where VI32(R)+ESO=VII12(R),ESO is the spin-orbit atomic splitting) and using the central field approximation for scattering from each"" state to derive a total σ(θ):σtot(θ)=σX12(θ)+σI32(θ)+aσII12(θ). The factor a takes into account the fraction of the spin-orbit excited state 2P1/2 produced in the oven. The I(32) and II(12) potentials are assumed to be very near the corresponding rare gas pairs and the greatest sensitivity in fitting the σ(θ) comes from the VX12 (R) potential. Agreement between calculated and experimental σ(θ) is good. Where spectroscopic data exist, for F-Xe, and Cl-Xe, the VX12(R) agreement is excellent. Quantum mechanical close coupling calculations are now underway for comparison, and to obtain absolute integral cross sections for elastic and inelastic channels.

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This work was supported by ONR and by the Materials, Chemical and Nuclear Science Division of the Department of Energy.


Author Institution: Materials and Molecular Research Division, Lawrence Berkeley Laboratory and Department of Chemistry University of California

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