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The Intermolecular Potential And Vibrational Relaxation Of The Ar-Co System, Gregory Allen Parker
The Intermolecular Potential And Vibrational Relaxation Of The Ar-Co System, Gregory Allen Parker
Theses and Dissertations
The angle, distance and vibration dependence of the Ar-CO intermolecular potential is calculated using the electron gas model to obtain the short range interaction which is smoothly joined onto the long range van der Waals tail which is obtained from accurate C_6, C_7, and C_8 coefficients. Our calculated second interaction virial coefficients are compared with experiment and with a simple adjustment of the Ar-CO potential an excellent agreement is obtained. Our spherically averaged potential is also in excellent agreement with a spherical potential inferred from high energy scattering data. Simplified expressions for the scattering amplitude and differential cross section are …
Van Der Waals Interactions Of Carbon Monoxide, Gregory A. Parker, Russell T. Pack
Van Der Waals Interactions Of Carbon Monoxide, Gregory A. Parker, Russell T. Pack
Faculty Publications
Pade approximant methods and experimental frequency dependent polarizabilities are used to calculate reliable van der Waals C6 coefficients for the interaction of CO with He, Ne, Ar, Kr, Xe, H, Li, Na, K, Rb, Cs, H2, N2, O2, CO2, and CO. Error bounds are given for the C6 coefficients and for the CO oscillator strength sums.