An Investigation of Radiation Damage Induced by Hydroxyl and Oxygen Impurities In BaF2 Crystal

Abstract

ABSTRACTThe radiation effect in hydrolyzed BaF2 was investigated through tile changes in their optical absorption and EPR spectra before and after γ-irradiation. The resulti demonstrated that hydroxyl and oxygen can be easily introduced into BaF2by means of a hydrolysis, the most likely modes are OH— ions substituting for fluorine and O2– ions substituting for fluorine associated with charge-compensating fluorine vacancies O2– — F+. Combining with the Hartree-Fock-Slater local-density discrete variational (HFS-Xα-DV) cluster calculation on some possible defects related to hydrogen and oxygen impurities, we propose that the radiation damage observed in hydrolyzedBaF2 can be explained in terms of OH— and O2– — F+ dissociation through a radiolysis.