upward

Defects

Defects in SiO2 and related dielectrics: science and technology, ed Pacchioni G, Skuja L,Griscom D L (Kluwer 2000)


Roma G, Limoge Y, Density functional theory investigation of native defects in SiO2: Self-doping and contribution to ionic conductivity, PRB 70, 174101 (2004)

Cannas M, Luminescence properties of point defects in silica, cond-mat/0203284

Glinka Y D, Lin S, Chen Y, Time-resolved photoluminescence study of silica nanoparticles as compared to bulk type-III fused silica, PRB 66, 035404 (2002)

Гриценко В А, Новиков Ю Н, Шапошников А В, Мороков Ю Н, Численное моделирование собственных дефектов в SiO2 и Si3N4, ФТП 35, 1041 (2001)

Meinardi F, Paleari A, Native and radiation-induced photoluminescent defects in SiO2: Role of impurities, PRB 58, 3511 (1998) – e

Hosono H, Matsunami N, Defect formation in amorphous SiO2 by ion implantation: Electronic excitation effects and chemical effects, Nucl Instr Meth Phys Res B 141, 566 (1998)

Tsai T E, Griscom D L, Experimental evidence for excitonic mechanism of defect generation in high-purity silica, PRL 67, 2517 (1991)

Oxygen deficient centers

Stirling A, Pasquarello A, Modelling of paramagnetic trivalent silicon defect centres in amorphous silica and at Si-SiO2 interfaces, JPC 17, S2099 (2005)

Sakurai Y, Effect of thermal heat treatment on oxygen-deficiency-associated defect centers: Relation to 1.8 eV photoluminescence bands in silica glass, JAP 95, 543 (2004)

Agnello S, Boscaino R, Cannas M, Gelardi F M, Leone M, Boizot B, Competitive relaxation processes of oxygen deficient centers in silica, PRB 67, 033202 (2003)

Шапошников А В, Гриценко В А, Жидомиров Г М, Роджер М, Захват дырок на двухкоординированный атом кремния в SiO2, ФТТ 44, 985 (2002)

Neutral oxygen vacancy and related centers

Alemany M M G, Chelikowsky R, Ab initio calculations for the interconversion of optically active defects in amorphous silica, PRB 73, 235211 (2006)

Buscarino G, Agnello S, Gelardi F M, Characterization of E'δ and triplet point defects in oxygen-deficient amorphous silicon dioxide, PRB 73, 045208 (2006)

Зацепин А Ф, Бирюков Д Ю, Кортов В С, Фотоэлектронная спектроскопия E'-центров в кристаллическом и стеклообразном диоксиде кремния, ФТТ 48, 229 (2006)

Mukhopadhyay S, Sushko P V, Stoneham A M, Shluger A L, Correlation between the atomic structure, formation energies, and optical absorption of neutral oxygen vacancies in amorphous silica, PRB 71, 235204 (2005)

Mukhopadhyay S, Sushko P V, Mashkov V A, Shluger A L, Spectroscopic features of dimer and dangling bond E' centres in amorphous silica, JPC 17, 1311 (2005)

Sushko P V, Mukhopadhyay S, Mysovsky A S, Sulimov V B, Taga A, Shluger A L, Structure and properties of defects in amorphous silica: new insights from embedded cluster calculations, JPC 17, S2115 (2005) – review of methods

Stesmans A, Clemer K, Afanas'ev V V, Electron spin resonance probing of fundamental point defects in nanometer-sized silica particles, PRB 72, 155335 (2005)

Tamura T, Lu G, Yamamoto R, Kohyama M, First-principles study of neutral oxygen vacancies in amorphous silica and germania, PRB 69, 195204 (2004)

Agnello S, Boscaino R, Buscarino G, Cannas M, Gelardi F M, Structural relaxation of E'γ centers in amorphous silica, PRB 66, 113201 (2002)

Lu Z et al, Structure, properties, and dynamics of oxygen vacancies in amorphous SiO2, PRL 89, 285505 (2002)

Stirling A, Pasquarello A, First-principles modeling of paramagnetic Si dangling-bond defects in amorphous SiO2, PRB 66, 245201 (2002)

Donadio D, Bernasconi M, Boero M, Ab initio simulations of photoinduced interconversions of oxygen deficient centers in amorphous silica, PRL 87, 195504 (2001)

Sulimov V, Casassa S, Pisani C, Garapon J, Poumellec B, Embedded cluster ab initio study of the neutral oxygen vacancy in quartz and cristobalite, Model Simul Mater Sci Eng 8, 763 (2000)

Oxygen related centers

Kajihara K, Skuja L, Hirano M, Hosono H, Role of mobile interstitial oxygen atoms in defect processes in oxides: interconversion between oxygen-associated defects in SiO2 glass, PRL 92, 015504 (2004)

Skuja L, Hirano M, Hosono H, Oxygen-related intrinsic defects in glassy SiO2: interstitial ozone molecules, PRL 84, 302 (2000)

Nonbridging oxygen

Cannas M, Vaccaro L, Boizot B, Spectroscopic parameters related to non-bridging oxygen hole centers in amorphous-SiO2, JNCS 352, 203 (2006)

Cannas M, Gelardi F M, Vacuum ultraviolet excitation of the 1.9-eV emission band related to nonbridging oxygen hole centers in silica, PRB 69, 153201 (2004)

Bakos T, Rashkeev S N, Pantelides S T, Optically active defects in SiO2: The nonbridging oxygen center and the interstitial OH molecule, PRB 70, 075203 (2004)

Suzuki T, Skuja L, Kajihara K, Hirano M, Kamiya T, Hosono H, Electronic structure of oxygen dangling bond in glassy SiO2: the role of hyperconjugation, PRL 90, 186404 (2003)

Anedda A, Bongiovanni G, Cannas M, Congiu F, Mura A, Martini M, A 1.9 eV photoluminescence induced by 4 eV photons in high-purity wet synthetic silica, JAP 74, 6993 (1993)

Self-trapped excitons

Ismail-Beigi S, Louie S G, Self-trapped excitons in silicon dioxide: mechanism and properties, PRL 95, 156401 (2005)

Extrinsic defects

d'Avezac M, Calandra M, Mauri F, Density functional theory description of hole-trapping in SiO2: A self-interaction-corrected approach, PRB 71, 205210 (2005) – STE on Al

Defects migration

Tatsumura K et al, Reactions and diffusion of atomic and molecular oxygen in the SiO2 network, PRB 72, 045205 (2005)

Yu D, Hwang G S, Kirichenko T A, Banerjee S K, Structure and diffusion of excess Si atoms in SiO2, PRB 72, 205204 (2005)