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2011

Interplay of excitonic effects and van Hove singularities in optical spectra: CaO and AlN polymorphs

Riefer, A., Fuchs, F., Rödl, C., Schleife, A., Bechstedt, F. & Goldhahn, R., Aug 17 2011, In : Physical Review B - Condensed Matter and Materials Physics. 84, 7, 075218.

Research output: Contribution to journalArticle

Optical absorption in degenerately doped semiconductors: Mott transition or Mahan excitons?

Schleife, A., Rödl, C., Fuchs, F., Hannewald, K. & Bechstedt, F., Nov 30 2011, In : Physical review letters. 107, 23, 236405.

Research output: Contribution to journalArticle

Tin dioxide from first principles: Quasiparticle electronic states and optical properties

Schleife, A., Varley, J. B., Fuchs, F., Rödl, C., Bechstedt, F., Rinke, P., Janotti, A. & Van De Walle, C. G., Jan 18 2011, In : Physical Review B - Condensed Matter and Materials Physics. 83, 3, 035116.

Research output: Contribution to journalArticle

2010

Ab initio description of heterostructural alloys: Thermodynamic and structural properties of Mgx Zn1-xO and Cd xZn1-xO

Schleife, A., Eisenacher, M., Rödl, C., Fuchs, F., Furthmüller, J. & Bechstedt, F., Jun 17 2010, In : Physical Review B - Condensed Matter and Materials Physics. 81, 24, 245210.

Research output: Contribution to journalArticle

Band lineup between silicon and transparent conducting oxides

Höffling, B., Schleife, A., Fuchs, F., Rödl, C. & Bechstedt, F., Jul 19 2010, In : Applied Physics Letters. 97, 3, 032116.

Research output: Contribution to journalArticle

Free-carrier absorption in nitrides from first principles

Kioupakis, E., Rinke, P., Schleife, A., Bechstedt, F. & Van De Walle, C. G., Jun 2 2010, In : Physical Review B - Condensed Matter and Materials Physics. 81, 24, 241201.

Research output: Contribution to journalArticle

Valence-band splittings in cubic and hexagonal AlN, GaN, and InN

Cláudio De Carvalho, L., Schleife, A., Fuchs, F. & Bechstedt, F., Dec 6 2010, In : Applied Physics Letters. 97, 23, 232101.

Research output: Contribution to journalArticle

2009

Band-structure and optical-transition parameters of wurtzite MgO, ZnO, and CdO from quasiparticle calculations

Schleife, A., Fuchs, F., Rödl, C., Furthmüller, J. & Bechstedt, F., Sep 2009, In : Physica Status Solidi (B) Basic Research. 246, 9, p. 2150-2153 4 p.

Research output: Contribution to journalArticle

Branch-point energies and band discontinuities of III-nitrides and III-/II-oxides from quasiparticle band-structure calculations

Schleife, A., Fuchs, F., Rödl, C., Furthmüller, J. & Bechstedt, F., Jan 19 2009, In : Applied Physics Letters. 94, 1, 012104.

Research output: Contribution to journalArticle

Optical and energy-loss spectra of MgO, ZnO, and CdO from ab initio many-body calculations

Schleife, A., Rödl, C., Fuchs, F., Furthmüller, J. & Bechstedt, F., Aug 6 2009, In : Physical Review B - Condensed Matter and Materials Physics. 80, 3, 035112.

Research output: Contribution to journalArticle

Valence-band electronic structure of CdO, ZnO, and MgO from x-ray photoemission spectroscopy and quasi-particle-corrected density-functional theory calculations

King, P. D. C., Veal, T. D., Schleife, A., Zúñiga-Pérez, J., Martel, B., Jefferson, P. H., Fuchs, F., Muñoz-Sanjosé, V., Bechstedt, F. & McConville, C. F., May 1 2009, In : Physical Review B - Condensed Matter and Materials Physics. 79, 20, 205205.

Research output: Contribution to journalArticle

2008

Ab-initio studies of electronic and spectroscopic properties of MgO, ZnO and CdO

Schleife, A., Rödl, C., Fuchs, F., Furthmüller, J., Bechstedt, F., Jefferson, P. H., Veal, T. D., McConville, C. F., Piper, L. F. J., DeMasi, A., Smith, K. E., Lösch, H., Goldhahn, R., Cobet, C., Zúñiga-Pérez, J. & Muñoz-Sanjosé, V., Nov 2008, In : Journal of the Korean Physical Society. 53, 5 PART 2, p. 2811-2815 5 p.

Research output: Contribution to journalArticle

Band structure of ZnO from resonant x-ray emission spectroscopy

Preston, A. R. H., Ruck, B. J., Piper, L. F. J., Demasi, A., Smith, K. E., Schleife, A., Fuchs, F., Bechstedt, F., Chai, J. & Durbin, S. M., Oct 14 2008, In : Physical Review B - Condensed Matter and Materials Physics. 78, 15, 155114.

Research output: Contribution to journalArticle

Efficient O (N2) approach to solve the Bethe-Salpeter equation for excitonic bound states

Fuchs, F., Rödl, C., Schleife, A. & Bechstedt, F., Aug 5 2008, In : Physical Review B - Condensed Matter and Materials Physics. 78, 8, 085103.

Research output: Contribution to journalArticle

Electronic structure of single-crystal rocksalt CdO studied by soft x-ray spectroscopies and ab initio calculations

Piper, L. F. J., DeMasi, A., Smith, K. E., Schleife, A., Fuchs, F., Bechstedt, F., Zuniga-Pérez, J. & Munoz-Sanjosé, V., Mar 10 2008, In : Physical Review B - Condensed Matter and Materials Physics. 77, 12, 125204.

Research output: Contribution to journalArticle

Observation of quantized subband states and evidence for surface electron accumulation in CdO from angle-resolved photoemission spectroscopy

Piper, L. F. J., Colakerol, L., King, P. D. C., Schleife, A., Zúñiga-Pérez, J., Glans, P. A., Learmonth, T., Federov, A., Veal, T. D., Fuchs, F., Muñoz-Sanjosé, V., Bechstedt, F., McConville, C. F. & Smith, K. E., Oct 29 2008, In : Physical Review B - Condensed Matter and Materials Physics. 78, 16, 165127.

Research output: Contribution to journalArticle

2007

Strain influence on valence-band ordering and excitons in ZnO: An ab initio study

Schleife, A., Rödl, C., Fuchs, F., Furthmüller, J. & Bechstedt, F., Dec 20 2007, In : Applied Physics Letters. 91, 24, 241915.

Research output: Contribution to journalArticle

2006

First-principles study of ground- and excited-state properties of MgO, ZnO, and CdO polymorphs

Schleife, A., Fuchs, F., Furthmüller, J. & Bechstedt, F., Jun 29 2006, In : Physical Review B - Condensed Matter and Materials Physics. 73, 24, 245212.

Research output: Contribution to journalArticle