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Theoretical Study of the Photodissociation of Low Lying Excited States of Hydrogen Peroxide
Uppsala University, Teknisk-naturvetenskapliga vetenskapsområdet, Physics, Department of Quantum Chemistry. Chemistry, Department of Physical and Analytical Chemistry, Quantum Chemistry. Kvantkemi.
Uppsala University, Teknisk-naturvetenskapliga vetenskapsområdet, Physics, Department of Quantum Chemistry. Chemistry, Department of Physical and Analytical Chemistry, Quantum Chemistry. Kvantkemi.
Uppsala University, Teknisk-naturvetenskapliga vetenskapsområdet, Physics, Department of Quantum Chemistry. Chemistry, Department of Physical and Analytical Chemistry, Quantum Chemistry. Kvantkemi.
2004 (English)In: Molecular Physics, Vol. 102, no 2575Article in journal (Refereed) Published
Abstract [en]

In order to explain recent photofragmentation experiments of hydrogen peroxide, the vertical excitation energies, potential-energy curves and surfaces, harmonic vibrational frequencies, and transition moments for a number of low lying excited states were calculated. The accessibility of different photodissociation channels for different excitation wavelengths was discussed, on the basis of the calculated results.

Place, publisher, year, edition, pages
2004. Vol. 102, no 2575
Keyword [en]
Quantum Chemistry, Photodissociation, Hydrogen Peroxide
National Category
Theoretical Chemistry
Identifiers
URN: urn:nbn:se:uu:diva-72649OAI: oai:DiVA.org:uu-72649DiVA: diva2:100560
Available from: 2007-02-01 Created: 2007-02-01 Last updated: 2011-01-12

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Persson, PetterLunell, Sten

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