Radiation-Induced Chemical Yields of Carbon-Centered Radicals and Hydrogen Atoms from the Gamma Irradiation of <i>n</i> -Dodecane

This study investigates the radiolytic yields of carbon-centered radicals and hydrogen atoms in <i>n</i>-dodecane under gamma irradiation. Utilizing molecular iodine (I<sub>2</sub>) and 2,4,6-tri<i>tert</i>-butylnitrosobenzene (3tBNB) as radical scavengers, we quantified the yields of molecular hydrogen and various carbon-centered radicals formed from bond scission of the solvent excited states. The yield of primary alkyl radicals was significantly lower than that of secondary radicals, aligning with expected stabilities and bond dissociation energies. For the overall loss of <i>n</i>-dodecane, total yields of 0.598 ± 0.004 species/100 eV for C-C bond scission, 1.648 ± 0.012 species/100 eV for C-H bond scission, and 3.20 ± 0.10 species/100 eV for unimolecular H<sub>2</sub> elimination were determined. Notably, the I<sub>2</sub> scavenging data provided robust estimates, while the data from 3tBNB indicated that it is not as efficient at trapping radicals. This research enhances our understanding of radiolytic processes in <i>n</i>-dodecane and offers insights for future studies on the behavior of hydrocarbons under ionizing radiation, with implications for improving used nuclear fuel reprocessing strategies.

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Publication Details

Journal
The Journal of Physical Chemistry A
Published
2025-11-04
DOI
https://doi.org/10.1021/acs.jpca.5c06414
Citations
1
Primary Topic
Radioactive element chemistry and processing
Type
article
Field-Weighted Citation Impact
0.54
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article

Radiation-Induced Chemical Yields of Carbon-Centered Radicals and Hydrogen Atoms from the Gamma Irradiation of n -Dodecane

Aliaksandra Lisouskaya, John R. Klaehn, Corey D. Pilgrim, Ilya S. Sosulin et al.
1 citations
The Journal of Physical Chemistry A
Radioactive element chemistry and processing
0.54
article

Radiation-Induced Chemical Yields of Carbon-Centered Radicals and Hydrogen Atoms from the Gamma Irradiation of n -Dodecane

Aliaksandra Lisouskaya, John R. Klaehn, Corey D. Pilgrim, Ilya S. Sosulin, Jacy K. Conrad, Joseph R. Wilbanks, K. R. ANDERSON, Gregory P. Horne
article en
1 citations

Abstract

This study investigates the radiolytic yields of carbon-centered radicals and hydrogen atoms in <i>n</i>-dodecane under gamma irradiation. Utilizing molecular iodine (I<sub>2</sub>) and 2,4,6-tri<i>tert</i>-butylnitrosobenzene (3tBNB) as radical scavengers, we quantified the yields of molecular hydrogen and various carbon-centered radicals formed from bond scission of the solvent excited states. The yield of primary alkyl radicals was significantly lower than that of secondary radicals, aligning with expected stabilities and bond dissociation energies. For the overall loss of <i>n</i>-dodecane, total yields of 0.598 ± 0.004 species/100 eV for C-C bond scission, 1.648 ± 0.012 species/100 eV for C-H bond scission, and 3.20 ± 0.10 species/100 eV for unimolecular H<sub>2</sub> elimination were determined. Notably, the I<sub>2</sub> scavenging data provided robust estimates, while the data from 3tBNB indicated that it is not as efficient at trapping radicals. This research enhances our understanding of radiolytic processes in <i>n</i>-dodecane and offers insights for future studies on the behavior of hydrocarbons under ionizing radiation, with implications for improving used nuclear fuel reprocessing strategies.

The Journal of Physical Chemistry AVol. 129(45)
University of Notre Dame (US), Idaho National Laboratory (US)
Openalex Percentile: Top 29%
Radioactive element chemistry and processing
0.54
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