Proton binding energies had been calculated using the second order proton propagator method. This uses the any particle molecular orbital Hartee-Fock (APMO-HF). Results obtained from second order propagator (APMO-P2) are in agreement with Threshold Ion-Pair Production Spectroscopy (TIPPS).The formulation will be described in detail. Additional results for proton affinities and H+ solvation energy will be discussed.

Calculation of proton binding energies with propagator methods

245th National Meeting (2013)

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