User menu

Quasiparticle electronic structure of barium-silicon oxynitrides for white-LED application

Bibliographic reference Bertrand, Bruno ; Poncé, Samuel ; Waroquiers, David ; Stankovski, Martin ; Giantomassi, Matteo ; et. al. Quasiparticle electronic structure of barium-silicon oxynitrides for white-LED application. In: Physical Review B, Vol. 88, no.7, p. 075136 1-10 (2013)
Permanent URL
  1. M. Nazarov, New Generation of Europium and Terbium Activated Phosphors (2011)
  2. W. M. Yen, Phosphor Handbook: Second Edition (2007)
  3. K. Uheda, 14th International Display Workshop (2007)
  4. Mikami Masayoshi, Shimooka Satoshi, Uheda Kyota, Imura Hiroyuki, Kijima Naoto, New Green Phosphor Ba3Si6O12N2:Eu for White LED: Crystal Structure and Optical Properties, 10.4028/
  5. Kim Hyun-Gu, Kang Eun-Hee, Kim Bo-Hye, Hong Seong-Hyeon, Preparation and luminescence properties of phosphor, 10.1016/j.optmat.2013.01.042
  6. Stadler Florian, Schnick Wolfgang, Die neuen Schichtsilicate Ba3Si6O9N4 und Eu3Si6O9N4, 10.1002/zaac.200500452
  8. Braun Cordula, Seibald Markus, Börger Saskia L., Oeckler Oliver, Boyko Teak D., Moewes Alexander, Miehe Gerhard, Tücks Andreas, Schnick Wolfgang, Material Properties and Structural Characterization of M3Si6O12N2:Eu2+ (M=Ba, Sr)-A Comprehensive Study on a Promising Green Phosphor for pc-LEDs, 10.1002/chem.201000660
  9. Tang JiaYe, Chen JunHua, Hao LuYuan, Xu Xin, Xie WenJie, Li QunXiang, Green Eu2+-doped Ba3Si6O12N2 phosphor for white light-emitting diodes: Synthesis, characterization and theoretical simulation, 10.1016/j.jlumin.2011.02.007
  10. Porob Digamber G., Manepalli Satya Kishore, Prasanth Kumar Nammalwar, Setlur Anant, Synthesis and Luminescence Properties of Green Oxynitride Phosphor, 10.1149/1.3578025
  11. Song Y.H., Choi T.Y., Senthil K., Masaki T., Yoon D.H., Photoluminescence properties of green-emitting Eu2+-activated Ba3Si6O12N2 oxynitride phosphor for white LED applications, 10.1016/j.matlet.2011.07.060
  12. Kang E.-H., Choi S.-W., Hong S.-H., Synthesis of Ba3Si6O12N2:Eu2+ Green Phosphors Using Ba3SiO5:Eu2+ Precursor and Their Luminescent Properties, 10.1149/2.015201jss
  13. Dorenbos P, Thermal quenching of Eu2+5d–4f luminescence in inorganic compounds, 10.1088/0953-8984/17/50/027
  14. Martin Richard M., Electronic Structure : Basic Theory and Practical Methods, ISBN:9780511805769, 10.1017/cbo9780511805769
  15. Perdew John P., Burke Kieron, Ernzerhof Matthias, Generalized Gradient Approximation Made Simple, 10.1103/physrevlett.77.3865
  16. Waroquiers David, Lherbier Aurélien, Miglio Anna, Stankovski Martin, Poncé Samuel, Oliveira Micael J. T., Giantomassi Matteo, Rignanese Gian-Marco, Gonze Xavier, Band widths and gaps from the Tran-Blaha functional: Comparison with many-body perturbation theory, 10.1103/physrevb.87.075121
  17. W. G. Aulbur, Solid State Physics (1999)
  18. van Schilfgaarde M., Kotani Takao, Faleev S., Quasiparticle Self-ConsistentGWTheory, 10.1103/physrevlett.96.226402
  19. Curtarolo Stefano, Hart Gus L. W., Nardelli Marco Buongiorno, Mingo Natalio, Sanvito Stefano, Levy Ohad, The high-throughput highway to computational materials design, 10.1038/nmat3568
  20. Blöchl P. E., Projector augmented-wave method, 10.1103/physrevb.50.17953
  21. Perdew John P., Burke Kieron, Ernzerhof Matthias, Generalized Gradient Approximation Made Simple, 10.1103/physrevlett.77.3865
  22. Holzwarth N.A.W., Tackett A.R., Matthews G.E., A Projector Augmented Wave (PAW) code for electronic structure calculations, Part I: atompaw for generating atom-centered functions, 10.1016/s0010-4655(00)00244-7
  23. W. H. Press, Numerical Recipes (Fortran) (1989)
  24. Giantomassi M., Stankovski M., Shaltaf R., Grüning M., Bruneval F., Rinke P., Rignanese G.-M., Electronic properties of interfaces and defects from many-body perturbation theory: Recent developments and applications, 10.1002/pssb.201046094
  25. Monkhorst Hendrik J., Pack James D., Special points for Brillouin-zone integrations, 10.1103/physrevb.13.5188
  26. Shaltaf R., Rangel T., Grüning M., Gonze X., Rignanese G.-M., Hamann D. R., Electronic properties of zircon and hafnon from many-body perturbation theory, 10.1103/physrevb.79.195101
  27. Bruneval Fabien, Gonze Xavier, AccurateGWself-energies in a plane-wave basis using only a few empty states: Towards large systems, 10.1103/physrevb.78.085125
  28. Godby R. W., Needs R. J., Metal-insulator transition in Kohn-Sham theory and quasiparticle theory, 10.1103/physrevlett.62.1169
  29. Lebègue S., Arnaud B., Alouani M., Bloechl P. E., Implementation of an all-electron GW approximation based on the projector augmented wave method without plasmon pole approximation: Application to Si, SiC, AlAs, InAs, NaH, and KH, 10.1103/physrevb.67.155208
  30. Bohm David, Pines David, A Collective Description of Electron Interactions: III. Coulomb Interactions in a Degenerate Electron Gas, 10.1103/physrev.92.609
  31. Gonze X., Amadon B., Anglade P.-M., Beuken J.-M., Bottin F., Boulanger P., Bruneval F., Caliste D., Caracas R., Côté M., Deutsch T., Genovese L., Ghosez Ph., Giantomassi M., Goedecker S., Hamann D.R., Hermet P., Jollet F., Jomard G., Leroux S., Mancini M., Mazevet S., Oliveira M.J.T., Onida G., Pouillon Y., Rangel T., Rignanese G.-M., Sangalli D., Shaltaf R., Torrent M., Verstraete M.J., Zerah G., Zwanziger J.W., ABINIT: First-principles approach to material and nanosystem properties, 10.1016/j.cpc.2009.07.007
  32. Momma Koichi, Izumi Fujio, VESTA 3for three-dimensional visualization of crystal, volumetric and morphology data, 10.1107/s0021889811038970
  33. Dorenbos P, Anomalous luminescence of Eu2  and Yb2  in inorganic compounds, 10.1088/0953-8984/15/17/318
  34. Oshikiri M., Aryasetiawan F., Imanaka Y., Kido G., Quasiparticle effective-mass theory in semiconductors, 10.1103/physrevb.66.125204
  35. Mikami Masayoshi, Response function calculations of Ba3Si6O12N2 and Ba3Si6O9N4 for the understanding of the optical properties of the Eu-doped phosphors, 10.1016/j.optmat.2012.11.014
  36. Mikami M., Computational Chemistry Approach for White LED (Oxy)Nitride Phosphors, 10.1149/2.006302jss
  37. Mikami Masayoshi, Kijima Naoto, 5d Levels of rare-earth ions in oxynitride/nitride phosphors: To what extent is the idea covalency reliable?, 10.1016/j.optmat.2010.07.020