Publications of Matthias Scheffler
All genres
Journal Article (599)
2007
Journal Article
Bücking, Norbert, Matthias Scheffler, and : Theory of optical excitation and relaxation phenomena at semiconductor surfaces: linking density functional and density matrix theory.
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Freysoldt, Christoph, Philipp Eggert, Patrick Rinke, Arno Schindlmayr, and Matthias Scheffler: Dielectric anisotropy in the GW space-time method.
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Freysoldt, Christoph, Patrick Rinke and Matthias Scheffler: Ultrathin oxides: Bulk-oxide-like model surfaces or unique films?
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Friák, Martin, Arno Schindlmayr and Matthias Scheffler: Ab initio study of half-metal to metal transition in strained magnetite.
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Hammerschmidt, Thomas, Peter Kratzer and Matthias Scheffler: Elastic response of cubic crystals to biaxial strain: Analytic results and comparison to density functional theory for InAs.
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Hortamani, Mahboubeh, Peter Kratzer and Matthias Scheffler: Density-functional study of Mn monosilicide on the Si(111) surface: Film formation versus island nucleation.
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Hu, Qing-Miao, Karsten Reuter and Matthias Scheffler: Erratum: Towards an exact treatment of exchange and correlation in materials: Application to the ``CO adsorption puzzle'' and other systems [Phys. Rev. Lett. 98, 176103 (2007)].
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Hu, Qing-Miao, Karsten Reuter and Matthias Scheffler: Towards an exact treatment of exchange and correlation in materials: Application to the "CO adsorption puzzle" and other systems.
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and Matthias Scheffler: Expedition zwischen Physik und Chemie: Chemie-Nobelpreis 2007 an Gerhard Ertl.
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Kratzer, Peter, Seyed Javad Hashemifar, Hua Wu, Mahboubeh Hortamani and Matthias Scheffler: Transition-metal silicides as materials for magnet-semiconductor heterostructures.
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, , , , Mahboubeh Hortamani, Peter Kratzer and Matthias Scheffler: Electronic structure changes of Si(001)-(2x1) from subsurface Mn observed by STM.
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Li, Bo, Angelos Michaelides and Matthias Scheffler: Density functional theory study of flat and stepped NaCl(001).
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Reuter, Karsten and Matthias Scheffler: Erratum: Composition, structure, and stability of RuO2(110) as a function of oxygen pressure [Phys. Rev. B 65, 035406 (2001)].
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Rinke, Patrick, Abdallah Qteish, and Matthias Scheffler: Exciting prospects for solids: Exact-exchange based functionals meet quasiparticle energy calculations.
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Rogal, Jutta, Karsten Reuter and Matthias Scheffler: CO oxidation at Pd(100): A first-principles constrained thermodynamics study.
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Rogal, Jutta, Karsten Reuter and Matthias Scheffler: First-principles statistical mechanics study of the stability of a subnanometer thin surface oxide in reactive environments: CO oxidation at Pd(100).
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, Peter Kratzer, Matthias Scheffler, and : Effect of post-growth annealing on the optical properties of InAs/GaAs quantum dots: A tight-binding study.
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Santra, Biswajit, Angelos Michaelides and Matthias Scheffler: On the accuracy of density-functional theory exchange-correlation functionals for H bonds in small water clusters: Benchmarks approaching the complete basis set limit.
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, Hakim Meskine, Karsten Reuter, Matthias Scheffler and Horia Metiu: Does phenomenological kinetics provide an adequate description of heterogeneous catalytic reactions?
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Wu, Hua, and Matthias Scheffler: Density-functional theory study of half-metallic heterostructures: Interstitial Mn in Si.