Comparison of oxygen vacancy and interstitial oxygen in KDP and ADP crystals from density functional theory calculations
Tingting Sui, Liening Wei, Xingzhong Cao, Mingxia Xu, Lisong Zhang, Xian Zhao, Zhenxue Chen, Yanlu Li, Xinguang Xu, Xun Sun
Topics & Concepts
Ammonium dihydrogen phosphateCrystallographic defectOxygenCrystal (programming language)Absorption (acoustics)Density functional theoryChemistryIrradiationMaterials scienceCrystallographyVacancy defectAnalytical Chemistry (journal)PhotochemistryComputational chemistryPhysicsProgramming languageComputer scienceOrganic chemistryChromatographyComposite materialNuclear physicsFertilizerPhotorefractive and Nonlinear OpticsNonlinear Optical Materials ResearchSolid State Laser Technologies