Please note that LibreCat no longer supports Internet Explorer versions 8 or 9 (or earlier).
We recommend upgrading to the latest Internet Explorer, Google Chrome, or Firefox.
24 Publications
2024 | Journal Article | LibreCat-ID: 60581
Ruiz Alvarado, I. A., Dreßler, C., & Schmidt, W. G. (2024). Band alignment at InP/TiO2 interfaces from density-functional theory. Journal of Physics: Condensed Matter, 37(7), Article 075001. https://doi.org/10.1088/1361-648x/ad9725
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 13429 | 
Bocchini, A., Neufeld, S., Gerstmann, U., & Schmidt, W. G. (2019). Oxygen and potassium vacancies in KTP calculated from first principles. Journal of Physics: Condensed Matter, 31, 385401. https://doi.org/10.1088/1361-648x/ab295c
LibreCat
| DOI
| Download (ext.)
2017 | Journal Article | LibreCat-ID: 13418
Sanna, S., & Schmidt, W. G. (2017). LiNbO3 surfaces from a microscopic perspective. Journal of Physics: Condensed Matter, Article 413001. https://doi.org/10.1088/1361-648x/aa818d
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 13803
Giannozzi, P., Andreussi, O., Brumme, T., Bunau, O., Buongiorno Nardelli, M., Calandra, M., Car, R., Cavazzoni, C., Ceresoli, D., Cococcioni, M., Colonna, N., Carnimeo, I., Dal Corso, A., de Gironcoli, S., Delugas, P., DiStasio, R. A., Ferretti, A., Floris, A., Fratesi, G., … Baroni, S. (2017). Advanced capabilities for materials modelling with Quantum ESPRESSO. Journal of Physics: Condensed Matter, 29(46), Article 465901. https://doi.org/10.1088/1361-648x/aa8f79
LibreCat
| DOI
2015 | Journal Article | LibreCat-ID: 22946
Liu, H., Heinze, D. F., Thanh Duc, H., Schumacher, S., & Meier, T. (2015). Curvature effects in the band structure of carbon nanotubes including spin–orbit coupling. Journal of Physics: Condensed Matter, 27(44), Article 445501. https://doi.org/10.1088/0953-8984/27/44/445501
LibreCat
| DOI
2015 | Journal Article | LibreCat-ID: 13922
Liu, H., Heinze, D. F., Thanh Duc, H., Schumacher, S., & Meier, T. (2015). Curvature effects in the band structure of carbon nanotubes including spin–orbit coupling. Journal of Physics: Condensed Matter, 27(44), Article 445501. https://doi.org/10.1088/0953-8984/27/44/445501
LibreCat
| DOI
2014 | Journal Article | LibreCat-ID: 13511
Landmann, M., Köhler, T., Rauls, E., Frauenheim, T., & Schmidt, W. G. (2014). The atomic structure of ternary amorphous TixSi1−xO2hybrid oxides. Journal of Physics: Condensed Matter, 26, Article 253201. https://doi.org/10.1088/0953-8984/26/25/253201
LibreCat
| DOI
2013 | Journal Article | LibreCat-ID: 7260
Carrad, D. J., Burke, A. M., Reece, P. J., Lyttleton, R. W., Waddington, D. E. J., Rai, A., … Micolich, A. P. (2013). The effect of (NH4)2Sxpassivation on the (311)A GaAs surface and its use in AlGaAs/GaAs heterostructure devices. Journal of Physics: Condensed Matter, 25(32). https://doi.org/10.1088/0953-8984/25/32/325304
LibreCat
| DOI
2013 | Journal Article | LibreCat-ID: 4111
Riedl, T., Kirchner, A., Eymann, K., Shariq, A., Schlesiger, R., Schmitz, G., … Kieback, B. (2013). Elemental distribution, solute solubility and defect free volume in nanocrystalline restricted-equilibrium Cu–Ag alloys. Journal of Physics: Condensed Matter, 25(11). https://doi.org/10.1088/0953-8984/25/11/115401
LibreCat
| Files available
| DOI
2012 | Journal Article | LibreCat-ID: 7325
Schuster, J., Kim, T. Y., Batke, E., Reuter, D., & Wieck, A. D. (2012). Photoluminescence lineshape features of carbon δ-doped GaAs heterostructures. Journal of Physics: Condensed Matter, 24(16). https://doi.org/10.1088/0953-8984/24/16/165801
LibreCat
| DOI
2012 | Journal Article | LibreCat-ID: 13545
Landmann, M., Rauls, E., & Schmidt, W. G. (2012). The electronic structure and optical response of rutile, anatase and brookite TiO2. Journal of Physics: Condensed Matter, 24, Article 195503. https://doi.org/10.1088/0953-8984/24/19/195503
LibreCat
| DOI
2011 | Journal Article | LibreCat-ID: 29677
Helmstedt, A., Müller, N., Gryzia, A., Dohmeier, N., Brechling, A., Sacher, M., Heinzmann, U., Hoeke, V., Krickemeyer, E., Glaser, T., Bouvron, S., Fonin, M., & Neumann, M. (2011). Spin resolved photoelectron spectroscopy of [Mn6IIICrIII]3 +single-molecule magnets and of manganese compounds as reference layers. Journal of Physics: Condensed Matter, 23(26), Article 266001. https://doi.org/10.1088/0953-8984/23/26/266001
LibreCat
| DOI
2009 | Journal Article | LibreCat-ID: 13662
Blankenburg, S., & Schmidt, W. G. (2009). Glutamic acid adsorbed on Ag(110): direct and indirect molecular interactions. Journal of Physics: Condensed Matter, 21, Article 185001. https://doi.org/10.1088/0953-8984/21/18/185001
LibreCat
| DOI
2009 | Journal Article | LibreCat-ID: 13802
Giannozzi, P., Baroni, S., Bonini, N., Calandra, M., Car, R., Cavazzoni, C., Ceresoli, D., Chiarotti, G. L., Cococcioni, M., Dabo, I., Dal Corso, A., de Gironcoli, S., Fabris, S., Fratesi, G., Gebauer, R., Gerstmann, U., Gougoussis, C., Kokalj, A., Lazzeri, M., … Wentzcovitch, R. M. (2009). QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials. Journal of Physics: Condensed Matter, 21(39), Article 395502. https://doi.org/10.1088/0953-8984/21/39/395502
LibreCat
| DOI
2008 | Journal Article | LibreCat-ID: 4557
Zrenner, A., Ester, P., Michaelis de Vasconcellos, S., Hübner, M. C., Lackmann, L., Stufler, S., & Bichler, M. (2008). Coherent optoelectronics with single quantum dots. Journal of Physics: Condensed Matter, 20(45). https://doi.org/10.1088/0953-8984/20/45/454210
LibreCat
| DOI
2008 | Journal Article | LibreCat-ID: 8616
Kaiser, F. J., Kohler, S., Hänggi, P., Malecha, M., Ebbecke, J., Wixforth, A., … Wieck, A. D. (2008). Theoretical and experimental investigations of Coulomb blockade in coupled quantum dot systems. Journal of Physics: Condensed Matter. https://doi.org/10.1088/0953-8984/20/37/374108
LibreCat
| DOI
2008 | Journal Article | LibreCat-ID: 13672
Hermann, A., Schwerdtfeger, P., & Schmidt, W. G. (2008). Theoretical study of the localization of excess electrons at the surface of ice. Journal of Physics: Condensed Matter, 20, Article 225003. https://doi.org/10.1088/0953-8984/20/22/225003
LibreCat
| DOI
2007 | Journal Article | LibreCat-ID: 8629
Pugžlys, A., Rizo, P. J., Ivanin, K., Slachter, A., Reuter, D., Wieck, A. D., … Loosdrecht, P. H. M. van. (2007). Charge and spin dynamics in a two-dimensional electron gas. Journal of Physics: Condensed Matter. https://doi.org/10.1088/0953-8984/19/29/295206
LibreCat
| DOI
2005 | Journal Article | LibreCat-ID: 23498
Meier, T., Reichelt, M., Koch, S. W., & Höfer, U. (2005). Femtosecond time-resolved five-wave mixing at silicon surfaces. Journal of Physics: Condensed Matter, 17(8), S221–S244. https://doi.org/10.1088/0953-8984/17/8/003
LibreCat
| DOI
2005 | Journal Article | LibreCat-ID: 23499
Meier, T., Reichelt, M., Koch, S. W., & Höfer, U. (2005). Femtosecond time-resolved five-wave mixing at silicon surfaces. Journal of Physics: Condensed Matter, 17(8), S221–S244. https://doi.org/10.1088/0953-8984/17/8/003
LibreCat
| DOI