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• W2022127644 endingPage "6055" @default.
• W2022127644 startingPage "6053" @default.
• W2022127644 abstract "A new, paramagnetic ($S=frac{1}{2}$) defect, designated the ${[mathrm{S}mathrm{i}{mathrm{O}}_{4}/mathrm{L}mathrm{i}]}^{0}$ center, consisting of an interstitial lithium atom, recently has been observed by Jani, Halliburton, and Halperin [Phys. Rev. Lett. 56, 1392 (1986)] in irradiated $ensuremath{alpha}$-quartz. A model for this defect has been developed utilizing ab initio self-consistent-field, electronic-structure calculations. In this model, the interstitial lithium nucleus lies on a crystal twofold axis passing through two adjacent silicon ions, and has a nearly neutral charge but very low spin density. The properties calculated using this model are consistent with all the available experimental information for this defect." @default.
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• W2022127644 date "1986-10-15" @default.
• W2022127644 modified "2023-09-27" @default.
• W2022127644 title "Electronic structure of the interstitial lithium-associated electron trap in crystalline quartz" @default.
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• W2022127644 doi "https://doi.org/10.1103/physrevb.34.6053" @default.
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