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Proceedings Paper

Proton affinity and proton transfer energy for selected organic molecules
Author(s): T. Wroblewski; L. Ziemczonek; K. Szerement; G. P. Karwasz
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Paper 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.

Paper Details

Date Published: 1 June 2005
PDF: 4 pages
Proc. SPIE 5849, Fifth Workshop on Atomic and Molecular Physics, (1 June 2005); doi: 10.1117/12.629524
Show Author Affiliations
T. Wroblewski, Pomeranian Pedagogical Academy (Poland)
L. Ziemczonek, Pomeranian Pedagogical Academy (Poland)
K. Szerement, Pomeranian Pedagogical Academy (Poland)
G. P. Karwasz, Pomeranian Pedagogical Academy (Poland)

Published in SPIE Proceedings Vol. 5849:
Fifth Workshop on Atomic and Molecular Physics
Jerzy Kwela; Ryszard Drozdowski; Tomasz J. Wasowicz, Editor(s)

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