Revised defect transition levels and optical transitions in LiGa5O8 are obtained by allowing symmetry-breaking relaxations, with special focus on the Li vacancy as the shallowest acceptor and on carbon impurities.
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Symmetry breaking structural relaxation and optical transitions of native defects and carbon impurities in LiGa$_5$O$_8$
Revised defect transition levels and optical transitions in LiGa5O8 are obtained by allowing symmetry-breaking relaxations, with special focus on the Li vacancy as the shallowest acceptor and on carbon impurities.