A natural quartz, annealed first at 800°C and then irradiated with a 3.5 MeV
electron beam, has been investigated by single-crystal electron paramagnetic
resonance (EPR) spectroscopy at X- and W-band frequencies from 110 K to 298 K. The
W-band EPR spectra allow better separation of two previously reported
radiation-induced defects (D and E) and improved determinations of their spin
Hamiltonian parameters. These defects have similar g tensors with the
gmax axes approximately along an O—O pair and
gmin axes perpendicular to the short Si—O bonds, but
different 27Al hyperfine structures. Centre E is also
characterized by a 29Si hyperfine structure
(A/geβe = ~0.4 mT). These spin
Hamiltonian parameters, together with results from density functional theory (DFT)
calculations, suggest centre E to be a new variant of peroxy radicals in quartz,
whereas a peroxy radical model for centre D remains tentative. Thermal stabilities
and decay kinetics of centres D and E have been investigated by use of isochronal
and isothermal annealing experiments on a neutron-irradiated quartz and six smoky
quartz crystals in druses from a U deposit.