Publications of Matthias Scheffler
All genres
Journal Article (603)
2009
Journal Article
Matthias Scheffler and : , , , , , , Two-dimensional electron gases: Theory of ultrafast dynamics of electron-phonon interactions in graphene, surfaces, and quantum wells.
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Rinke, Patrick, , Matthias Scheffler and : Defect formation energies without the band-gap problem: Combining density-functional theory and the GW approach for the silicon self-interstitial.
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Santra, Biswajit, Angelos Michaelides and Matthias Scheffler: Coupled cluster benchmarks of water monomers and dimers extracted from density-functional theory liquid water: The importance of monomer deformations.
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Angelos Michaelides, , Karsten Reuter, , , Matthias Scheffler and : , , , Experimental and theoretical study of oxygen adsorption structures on Ag(111).
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Tkatchenko, Alexandre, , and Matthias Scheffler: Dispersion-corrected Møller-Plesset second-order perturbation theory.
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Tkatchenko, Alexandre and Matthias Scheffler: Accurate molecular van der Waals interactions from ground-state electron density and free-atom reference data.
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Matthias Scheffler and : , , Strain effects in group-III nitrides: Deformation potentials for AlN, GaN, and InN.
2008
Journal Article
Behler, Jörg, Karsten Reuter and Matthias Scheffler: Nonadiabatic effects in the dissociation of oxygen molecules at the Al(111) surface.
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Buecking, Norbert, Peter Kratzer, Matthias Scheffler and : Linking density functional and density-matrix theory: Picosecond electron relaxation at the Si(100) surface.
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Freysoldt, Christoph, Philipp Eggert, Patrick Rinke, Arno Schindlmayr and Matthias Scheffler: Screening in two dimensions: GW calculations for surfaces and thin films using the repeated-slab approach.
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Gómez-Abal, Ricardo, Xinzheng Li, Matthias Scheffler and : Influence of the core-valence interaction and of the pseudopotential approximation on the electron self-energy in semiconductors.
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Hammerschmidt, Thomas, Peter Kratzer and Matthias Scheffler: Analytic many-body potential for InAs/GaAs surfaces and nanostructures: Formation energy of InAs quantum dots.
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Hortamani, Mahboubeh, , Peter Kratzer, and Matthias Scheffler: Exchange interactions and critical temperature of bulk and thin films of MnSi: A density functional theory study.
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Kitchin, John R., Karsten Reuter and Matthias Scheffler: Alloy surface segregation in reactive environments: First-principles atomistic thermodynamics study of Ag3Pd(111) in oxygen atmospheres.
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Li, Bo, Angelos Michaelides and Matthias Scheffler: How strong is the bond between water and salt?
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Matthias Scheffler: , , , , and A combined DFT/LEED-approach for complex oxide surface structure determination: Fe3O4(0 0 1).
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Matthias Scheffler: , and First-principles investigation of Ag-Cu alloy surfaces in an oxidizing environment.
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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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Rinke, Patrick, Momme Winkelnkemper, , , and Matthias Scheffler: Consistent set of band parameters for the group-III nitrides AlN, GaN, and InN.
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Rogal, Jutta, Karsten Reuter and Matthias Scheffler: CO oxidation on Pd(100) at technologically relevant pressure conditions: First-principles kinetic Monte Carlo study.