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19 Publications


2019 | Journal Article | LibreCat-ID: 13429
Bocchini A, Neufeld S, Gerstmann U, Schmidt WG. Oxygen and potassium vacancies in KTP calculated from first principles. Journal of Physics: Condensed Matter. 2019. doi:10.1088/1361-648x/ab295c
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2017 | Journal Article | LibreCat-ID: 13418
Sanna S, Schmidt WG. LiNbO3 surfaces from a microscopic perspective. Journal of Physics: Condensed Matter. 2017. doi:10.1088/1361-648x/aa818d
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2017 | Journal Article | LibreCat-ID: 13803
Giannozzi P, Andreussi O, Brumme T, et al. Advanced capabilities for materials modelling with Quantum ESPRESSO. Journal of Physics: Condensed Matter. 2017;29(46). doi:10.1088/1361-648x/aa8f79
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2015 | Journal Article | LibreCat-ID: 13922
Liu H, Heinze DF, Thanh Duc H, Schumacher S, Meier T. Curvature effects in the band structure of carbon nanotubes including spin–orbit coupling. Journal of Physics: Condensed Matter. 2015;27. doi:10.1088/0953-8984/27/44/445501
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2014 | Journal Article | LibreCat-ID: 13511
Landmann M, Köhler T, Rauls E, Frauenheim T, Schmidt WG. The atomic structure of ternary amorphous TixSi1−xO2hybrid oxides. Journal of Physics: Condensed Matter. 2014;26. doi:10.1088/0953-8984/26/25/253201
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2013 | Journal Article | LibreCat-ID: 7260
Carrad DJ, Burke AM, Reece PJ, et al. The effect of (NH4)2Sxpassivation on the (311)A GaAs surface and its use in AlGaAs/GaAs heterostructure devices. Journal of Physics: Condensed Matter. 2013;25(32). doi:10.1088/0953-8984/25/32/325304
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2013 | Journal Article | LibreCat-ID: 4111
Riedl T, Kirchner A, Eymann K, et al. Elemental distribution, solute solubility and defect free volume in nanocrystalline restricted-equilibrium Cu–Ag alloys. Journal of Physics: Condensed Matter. 2013;25(11). doi:10.1088/0953-8984/25/11/115401
LibreCat | Files available | DOI
 

2012 | Journal Article | LibreCat-ID: 13545
Landmann M, Rauls E, Schmidt WG. The electronic structure and optical response of rutile, anatase and brookite TiO2. Journal of Physics: Condensed Matter. 2012;24. doi:10.1088/0953-8984/24/19/195503
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2012 | Journal Article | LibreCat-ID: 7325
Schuster J, Kim TY, Batke E, Reuter D, Wieck AD. Photoluminescence lineshape features of carbon δ-doped GaAs heterostructures. Journal of Physics: Condensed Matter. 2012;24(16). doi:10.1088/0953-8984/24/16/165801
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2009 | Journal Article | LibreCat-ID: 13802
Giannozzi P, Baroni S, Bonini N, et al. QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials. Journal of Physics: Condensed Matter. 2009;21(39). doi:10.1088/0953-8984/21/39/395502
LibreCat | DOI
 

2009 | Journal Article | LibreCat-ID: 13662
Blankenburg S, Schmidt WG. Glutamic acid adsorbed on Ag(110): direct and indirect molecular interactions. Journal of Physics: Condensed Matter. 2009;21. doi:10.1088/0953-8984/21/18/185001
LibreCat | DOI
 

2008 | Journal Article | LibreCat-ID: 4557
Zrenner A, Ester P, Michaelis de Vasconcellos S, et al. Coherent optoelectronics with single quantum dots. Journal of Physics: Condensed Matter. 2008;20(45). doi:10.1088/0953-8984/20/45/454210
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2008 | Journal Article | LibreCat-ID: 13672
Hermann A, Schwerdtfeger P, Schmidt WG. Theoretical study of the localization of excess electrons at the surface of ice. Journal of Physics: Condensed Matter. 2008;20. doi:10.1088/0953-8984/20/22/225003
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2008 | Journal Article | LibreCat-ID: 8616
Kaiser FJ, Kohler S, Hänggi P, et al. Theoretical and experimental investigations of Coulomb blockade in coupled quantum dot systems. Journal of Physics: Condensed Matter. 2008. doi:10.1088/0953-8984/20/37/374108
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2007 | Journal Article | LibreCat-ID: 8629
Pugžlys A, Rizo PJ, Ivanin K, et al. Charge and spin dynamics in a two-dimensional electron gas. Journal of Physics: Condensed Matter. 2007. doi:10.1088/0953-8984/19/29/295206
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2004 | Journal Article | LibreCat-ID: 13712
Schmidt WG, Fuchs F, Hermann A, et al. Oxidation- and organic-molecule-induced changes of the Si surface optical anisotropy:ab initiopredictions. Journal of Physics: Condensed Matter. 2004;16:S4323-S4334. doi:10.1088/0953-8984/16/39/007
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2004 | Journal Article | LibreCat-ID: 13713
Palummo M, Pulci O, Sole RD, et al. The Bethe–Salpeter equation: a first-principles approach for calculating surface optical spectra. Journal of Physics: Condensed Matter. 2004;16:S4313-S4322. doi:10.1088/0953-8984/16/39/006
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1997 | Journal Article | LibreCat-ID: 13776
Nilen RWN, Connell SH, Britton DT, et al. The anisotropic electron - positron momentum distribution in diamond. Journal of Physics: Condensed Matter. 1997;9:6323-6333. doi:10.1088/0953-8984/9/29/017
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1993 | Journal Article | LibreCat-ID: 13857
Schmidt WG, Srivastava GP. Chemisorption of aluminium on GaAs(110). Journal of Physics: Condensed Matter. 1993;5(49):9025-9036. doi:10.1088/0953-8984/5/49/005
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