First-Principles Studies on the Electronic Structures and Optical Properties for the PbWO4 Crystal Containing V^2-pb-中国期刊网

摘要 Theelectronicstructures,dielectricfunctions,complexrefractiveindicesandabsorptionspectraforaperfectPbW04(PWO)crystalandthePWOcrystalscontainingleadvacancyV^2-pbhavebeencalculatedusingafull-potential(linearized)augmentedplane-wave(LAPW)+localorbitals(LO)methodwiththelatticestructureoptimized.Thepeaksoftheabsorptionspectracorrespondingtotheelectronictransitionshavebeenstudied.

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First-Principles Studies on the Electronic Structures and Optical Properties for the PbWO4 Crystal Containing V^2-pb

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First-Principles Studies on the Electronic Structures and Optical Properties for the PbWO4 Crystal Containing V^2-pb

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