Proton affinity and proton transfer energy for selected organic molecules

T. Wroblewski; L. Ziemczonek; K. Szerement; G. P. Karwasz

doi:10.1117/12.629524

1 June 2005 Proton affinity and proton transfer energy for selected organic molecules

T. Wroblewski, L. Ziemczonek, K. Szerement, G. P. Karwasz

Proceedings Volume 5849, Fifth Workshop on Atomic and Molecular Physics; (2005) https://doi.org/10.1117/12.629524
Event: Fifth Workshop on Atomic and Molecular Physics, 2004, Jurata, Poland

Abstract

The Hartree-Fock method in 6-311G** molecular orbitals basis set has been applied to calculations of proton affinities and proton transfer reaction energies for water methanol acetaldehyde ethanol acetone acetic acid methyl acetate and ethyl acetate.

Citation Download Citation

T. Wroblewski, L. Ziemczonek, K. Szerement, and G. P. Karwasz "Proton affinity and proton transfer energy for selected organic molecules", Proc. SPIE 5849, Fifth Workshop on Atomic and Molecular Physics, (1 June 2005); https://doi.org/10.1117/12.629524

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