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Assessment of periodic and cluster-in-vacuo models for first principles calculation of EPR parameters of paramagnetic defects in crystals: Rh2+ defects in NaCl as case study
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- Conference Paper
- C3
- open access
Which role do excited states play in radiation damage to organic solid-state compounds?
(2010) -
- Conference Paper
- C3
- open access
Direct-effect radiation chemistry of solid-state carbohydrates using EMR and DFT
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Oxidation and reduction products of X irradiation at 10 K in sucrose single crystals: radical identification by EPR, ENDOR, and DFT
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Electron magnetic resonance and density functional theory study of room temperature X-irradiated β-D-fructose single crystals