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726 Publications
1999 | Book Chapter | LibreCat-ID: 2435
Simon J, Reinefeld A, Heinz O. Large-Scale SCI Clusters in Practice: Architecture and Performance in SCI. In: Hellwagner H, Reinefeld A, eds. SCI: Scalable Coherent Interface. Architecture and Software for High-Performance Compute Clusters. Vol 1734. Lecture Notes in Computer Science (LNCS). Berlin / Heidelberg: Springer; 1999:367-381. doi:10.1007/10704208
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| DOI
2002 | Journal Article | LibreCat-ID: 13736
Schmidt WG, Bechstedt F, Lu W, Bernholc J. Interplay of surface reconstruction and surface electric fields in the optical anisotropy of GaAs(001). Physical Review B. 2002;66:0855334. doi:10.1103/physrevb.66.085334
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2005 | Journal Article | LibreCat-ID: 15849
Schumacher S, Czycholl G, Jahnke F, et al. Polariton propagation in shallow-confinement heterostructures: Microscopic theory and experiment showing the breakdown of the dead-layer concept. Physical Review B. 2005. doi:10.1103/physrevb.70.235340
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2005 | Journal Article | LibreCat-ID: 15850
Schumacher S, Czycholl G, Jahnke F, et al. Coherent propagation of polaritons in semiconductor heterostructures: Nonlinear pulse transmission in theory and experiment. Physical Review B. 2005. doi:10.1103/physrevb.72.081308
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2006 | Journal Article | LibreCat-ID: 15848
Schulz S, Schumacher S, Czycholl G. Tight-binding model for semiconductor quantum dots with a wurtzite crystal structure: From one-particle properties to Coulomb correlations and optical spectra. Physical Review B. 2006. doi:10.1103/physrevb.73.245327
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2006 | Journal Article | LibreCat-ID: 13684
Letzig T, Willig F, Hahn PH, Schmidt WG. Experimental and theoretical evidence for a hydrogen stabilizedc(2×2)reconstruction of the P-rich InP(001) surface. Physical Review B. 2006;74(24). doi:10.1103/physrevb.74.245307
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2006 | Journal Article | LibreCat-ID: 13688
Blankenburg S, Schmidt WG. Adsorption of phenylglycine on copper: Density functional calculations. Physical Review B. 2006;74(15). doi:10.1103/physrevb.74.155419
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2006 | Journal Article | LibreCat-ID: 13690
Thierfelder C, Hermann A, Schwerdtfeger P, Schmidt WG. Strongly bonded water monomers on the ice Ih basal plane: Density-functional calculations. Physical Review B. 2006;74(4). doi:10.1103/physrevb.74.045422
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2006 | Journal Article | LibreCat-ID: 13691
Biering S, Hermann A, Schmidt WG. Adsorption of water on chlorine-terminated Si(111) from first principles: Substrate-induced ordering versus intermolecular interactions. Physical Review B. 2006;73(23). doi:10.1103/physrevb.73.235429
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2007 | Journal Article | LibreCat-ID: 13677
Thierfelder C, Schmidt WG. Ethanol adsorbed on ice: A first-principles study. Physical Review B. 2007;76(19). doi:10.1103/physrevb.76.195426
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2007 | Journal Article | LibreCat-ID: 13678
Blankenburg S, Schmidt WG. Long-Range Chiral Recognition due to Substrate Locking and Substrate-Adsorbate Charge Transfer. Physical Review Letters. 2007;99(19). doi:10.1103/physrevlett.99.196107
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2007 | Journal Article | LibreCat-ID: 13680
Blankenburg S, Schmidt WG. Steric effects and chirality in the adsorption of glycine and phenylglycine on Cu(110). Nanotechnology. 2007;18. doi:10.1088/0957-4484/18/42/424030
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2007 | Journal Article | LibreCat-ID: 13681
Wippermann S, Schmidt WG, Calzolari A, et al. Quantum conductance of In nanowires on Si(111) from first principles calculations. Surface Science. 2007:4045-4047. doi:10.1016/j.susc.2007.04.053
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2007 | Journal Article | LibreCat-ID: 13683
Stekolnikov AA, Seino K, Bechstedt F, et al. Hexagon versus Trimer Formation in In Nanowires on Si(111): Energetics and Quantum Conductance. Physical Review Letters. 2007;98(2). doi:10.1103/physrevlett.98.026105
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2008 | Journal Article | LibreCat-ID: 13663
Wippermann S, Schmidt WG. Optical anisotropy of the In/Si(111)(4×1)/(8×2) nanowire array. Surface Science. 2008;603:247-250. doi:10.1016/j.susc.2008.11.013
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2008 | Journal Article | LibreCat-ID: 13666
Wippermann S, Schmidt WG. Water adsorption on clean Ni(111) and p(2×2)-Ni(111)-O surfaces calculated from first principles. Physical Review B. 2008;78(23). doi:10.1103/physrevb.78.235439
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2008 | Journal Article | LibreCat-ID: 13667
Blankenburg S, Schmidt WG. Spatial modulation of molecular adsorption energies due to indirect interaction. Physical Review B. 2008;78. doi:10.1103/physrevb.78.233411
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2008 | Journal Article | LibreCat-ID: 13668
Rauls E, Schmidt WG. Influence of the Side Group Aromaticity on the Organic Molecule Adsorption on Cu(110). Journal of Physical Chemistry C. 2008;112:11490-11494. doi:10.1021/jp8037297
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2008 | Journal Article | LibreCat-ID: 13669
Rauls E, Dijkstra SJ, Schmidt WG. Atomic structure and energetics of thec-GaN(001) surface. Physical Review B. 2008;78(11). doi:10.1103/physrevb.78.113302
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2008 | Journal Article | LibreCat-ID: 13670
Rauls E, Blankenburg S, Schmidt WG. DFT calculations of adenine adsorption on coin metal (110) surfaces. Surface Science. 2008;602:2170-2174. doi:10.1016/j.susc.2008.04.029
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2008 | Journal Article | LibreCat-ID: 13671
Hermann A, Schmidt WG, Schwerdtfeger P. Resolving the Optical Spectrum of Water: Coordination and Electrostatic Effects. Physical Review Letters. 2008;100(20). doi:10.1103/physrevlett.100.207403
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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: 13674
Wippermann S, Koch N, Schmidt WG. Adatom-Induced Conductance Modification of In Nanowires: Potential-Well Scattering and Structural Effects. Physical Review Letters. 2008;100(10). doi:10.1103/physrevlett.100.106802
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2008 | Journal Article | LibreCat-ID: 13675
Lange B, Schmidt WG. Ammonia adsorption on Cl/Si(001): First-principles calculations. Surface Science. 2008;602:1207-1211. doi:10.1016/j.susc.2008.01.024
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2008 | Journal Article | LibreCat-ID: 13676
Schmidt WG, Albrecht M, Wippermann S, et al. LiNbO3ground- and excited-state properties from first-principles calculations. Physical Review B. 2008;77. doi:10.1103/physrevb.77.035106
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2009 | Journal Article | LibreCat-ID: 15847
Kwong NH, Schumacher S, Binder R. Electron-Spin Beat Susceptibility of Excitons in Semiconductor Quantum Wells. Physical Review Letters. 2009. doi:10.1103/physrevlett.103.056405
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2009 | Journal Article | LibreCat-ID: 13576
Blankenburg S, Rauls E, Schmidt WG. The physics of highly ordered molecular rows. physica status solidi (c). 2009:153-156. doi:10.1002/pssc.200982459
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2009 | Journal Article | LibreCat-ID: 13577
Blankenburg S, Rauls E, Schmidt WG. The physics of highly ordered molecular rows. physica status solidi (c). 2009;7(2):153-156. doi:10.1002/pssc.200982459
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2009 | Journal Article | LibreCat-ID: 13578
Sanna S, Gavrilenko AV, Schmidt WG. Ab initioinvestigation of the LiNbO3(0001) surface. physica status solidi (c). 2009:145-148. doi:10.1002/pssc.200982456
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2009 | Journal Article | LibreCat-ID: 13579
Sanna S, Gavrilenko AV, Schmidt WG. Ab initioinvestigation of the LiNbO3(0001) surface. physica status solidi (c). 2009;7(2):145-148. doi:10.1002/pssc.200982456
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2009 | Journal Article | LibreCat-ID: 13580
Wippermann S, Schmidt WG, Thissen P, Grundmeier G. Dissociative and molecular adsorption of water onα-Al2O3(0001). physica status solidi (c). 2009;7(2):137-140. doi:10.1002/pssc.200982423
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2009 | Journal Article | LibreCat-ID: 13583
Scholle A, Greulich-Weber S, Rauls E, Schmidt WG, Gerstmann U. Vacancy clusters created via room temperature irradiation in 6H-SiC. Physica B: Condensed Matter. 2009;404:4742-4744. doi:10.1016/j.physb.2009.08.123
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2009 | Journal Article | LibreCat-ID: 13655
Thissen P, Grundmeier G, Wippermann S, Schmidt WG. Water adsorption on the α-Al2O3(0001) surface. Physical Review B. 2009;80(24). doi:10.1103/physrevb.80.245403
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2009 | Journal Article | LibreCat-ID: 13657
Sanna S, Schmidt WG, Frauenheim T, Gerstmann U. Rare-earth defect pairs in GaN: LDA+U calculations. Physical Review B. 2009;80(10). doi:10.1103/physrevb.80.104120
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2009 | Journal Article | LibreCat-ID: 13659
Blankenburg S, Rauls E, Schmidt WG. Role of Dihydrogen Bonds for the Stabilization of Self-Assembled Molecular Nanostructures. The Journal of Physical Chemistry C. 2009;113:12653-12657. doi:10.1021/jp902337p
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2009 | Journal Article | LibreCat-ID: 13660
Chandola S, Hinrichs K, Gensch M, et al. Structure of Si(111)-In Nanowires Determined from the Midinfrared Optical Response. Physical Review Letters. 2009;102(22). doi:10.1103/physrevlett.102.226805
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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
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2009 | Journal Article | LibreCat-ID: 13664
Lange B, Posner R, Pohl K, et al. Water adsorption on hydrogenated Si(111) surfaces. Surface Science. 2009;603:60-64. doi:10.1016/j.susc.2008.10.030
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2009 | Journal Article | LibreCat-ID: 13665
Landmann M, Rauls E, Schmidt WG. First-principles calculations of clean Au(110) surfaces and chemisorption of atomic oxygen. Physical Review B. 2009;79(4). doi:10.1103/physrevb.79.045412
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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
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2010 | Journal Article | LibreCat-ID: 15846
Schumacher S, Galbraith I, Ruseckas A, Turnbull GA, Samuel IDW. Dynamics of photoexcitation and stimulated optical emission in conjugated polymers: A multiscale quantum-chemistry and Maxwell-Bloch-equations approach. Physical Review B. 2010. doi:10.1103/physrevb.81.245407
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| DOI
2010 | Journal Article | LibreCat-ID: 13573
Thierfelder C, Sanna S, Schindlmayr A, Schmidt WG. Do we know the band gap of lithium niobate? Physica Status Solidi C. 2010;7(2):362-365. doi:10.1002/pssc.200982473
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2010 | Journal Article | LibreCat-ID: 13574
Gerstmann U, Rohrmüller M, Mauri F, Schmidt WG. Ab initiog-tensor calculation for paramagnetic surface states: hydrogen adsorption at Si surfaces. physica status solidi (c). 2010;7(2):157-160. doi:10.1002/pssc.200982462
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2010 | Journal Article | LibreCat-ID: 13581
Wippermann S, Schmidt WG, Bechstedt F, et al. Optical anisotropy of Si(111)-(4 × 1)/(8 × 2)-In nanowires calculated fromfirst-principles. physica status solidi (c). 2010;7(2):133-136. doi:10.1002/pssc.200982413
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| DOI
2010 | Journal Article | LibreCat-ID: 13826
Blankenburg S, Rauls E, Schmidt WG. Catalytic Action of a Cu(111) Surface on Tetraazaperopyrene Polymerization. The Journal of Physical Chemistry Letters. 2010;1:3266-3270. doi:10.1021/jz101389u
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| DOI
2010 | Journal Article | LibreCat-ID: 13827
Wippermann S, Schmidt WG. Entropy Explains Metal-Insulator Transition of the Si(111)-In Nanowire Array. Physical Review Letters. 2010;105(12). doi:10.1103/physrevlett.105.126102
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| DOI
2010 | Journal Article | LibreCat-ID: 13829
Krivosheeva AV, Sanna S, Schmidt WG. First-principles investigation of CO adsorption on Pt/Ge(001)-(4×2). Computational Materials Science. 2010;49(4):895-898. doi:10.1016/j.commatsci.2010.06.043
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| DOI
2010 | Journal Article | LibreCat-ID: 13830
Rauls E, Wiebe J, Schmidt WG. Understanding the cubic AlN growth plane from first principles. Journal of Crystal Growth. 2010;312:2892-2895. doi:10.1016/j.jcrysgro.2010.07.027
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| DOI
2010 | Journal Article | LibreCat-ID: 13832
Thierfelder C, Schmidt WG. First-principles study of water adsorption and a high-density interfacial ice structure on(1×1)-O/Rh(111). Physical Review B. 2010;82(11). doi:10.1103/physrevb.82.115402
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2010 | Journal Article | LibreCat-ID: 13833
Sanna S, Schmidt WG. Lithium niobateX-cut,Y-cut, andZ-cut surfaces fromab initiotheory. Physical Review B. 2010;81(21). doi:10.1103/physrevb.81.214116
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2010 | Journal Article | LibreCat-ID: 13834
Sanna S, Schmidt WG. GaN/LiNbO3 (0001) interface formation calculated from first-principles. Applied Surface Science. 2010;256:5740-5743. doi:10.1016/j.apsusc.2010.03.098
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2010 | Journal Article | LibreCat-ID: 13836
Rauls E, Blankenburg S, Schmidt WG. Chemical reactivity on surfaces: Modeling the imide synthesis from DATP and PTCDA on Au(111). Physical Review B. 2010;81(12). doi:10.1103/physrevb.81.125401
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| DOI
2010 | Journal Article | LibreCat-ID: 13838
Sanna S, Schmidt WG. GaN growth on LiNbO3 (0001) - a first-principles simulation. physica status solidi (c). 2010;7(7-8):2272-2274. doi:10.1002/pssc.200983649
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| DOI
2010 | Journal Article | LibreCat-ID: 13839
Blankenburg S, Schmidt WG. Temperature dependent stability of self-assembled molecular rows. physica status solidi (c). 2010;7(2):415-417. doi:10.1002/pssc.200982460
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| DOI
2010 | Journal Article | LibreCat-ID: 13841
Blankenburg S, Rauls E, Schmidt WG. The physics of highly ordered molecular rows. physica status solidi (c). 2010;7(2):153-156. doi:10.1002/pssc.200982459
LibreCat
| DOI
2010 | Journal Article | LibreCat-ID: 13842
Sanna S, Gavrilenko AV, Schmidt WG. Ab initio investigation of the LiNbO3(0001) surface. physica status solidi (c). 2010;7(2):145-148. doi:10.1002/pssc.200982456
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| DOI
2010 | Journal Article | LibreCat-ID: 13843
Wippermann S, Schmidt WG, Thissen P, Grundmeier G. Dissociative and molecular adsorption of water onα-Al2O3(0001). physica status solidi (c). 2010;7(2):137-140. doi:10.1002/pssc.200982423
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| DOI
2010 | Journal Article | LibreCat-ID: 4169
Priyadarshi S, Racu AM, Pierz K, et al. Reversal of Coherently Controlled Ultrafast Photocurrents by Band Mixing in Undoped GaAs Quantum Wells. Physical Review Letters. 2010;104(21). doi:10.1103/physrevlett.104.217401
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2010 | Journal Article | LibreCat-ID: 4172 | 
Piegdon KA, Declair S, Förstner J, et al. Tuning quantum-dot based photonic devices with liquid crystals. Optics Express. 2010;18(8). doi:10.1364/oe.18.007946
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2011 | Journal Article | LibreCat-ID: 13563
Schmidt WG, Babilon M, Thierfelder C, Sanna S, Wippermann S. Influence of Na adsorption on the quantum conductance and metal-insulator transition of the In-Si(111)(4×1)–(8×2) nanowire array. Physical Review B. 2011;84(11). doi:10.1103/physrevb.84.115416
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| DOI
2011 | Journal Article | LibreCat-ID: 13564
dos Santos LS, Schmidt WG, Rauls E. Group-VII point defects in ZnSe. Physical Review B. 2011;84(11). doi:10.1103/physrevb.84.115201
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2011 | Journal Article | LibreCat-ID: 13565
Müllegger S, Schöfberger W, Rashidi M, et al. Preserving Charge and Oxidation State of Au(III) Ions in an Agent-Functionalized Nanocrystal Model System. ACS Nano. 2011;5(8):6480-6486. doi:10.1021/nn201708c
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| DOI
2011 | Journal Article | LibreCat-ID: 13568
Mietze C, Landmann M, Rauls E, et al. Band offsets in cubic GaN/AlN superlattices. Physical Review B. 2011;83(19). doi:10.1103/physrevb.83.195301
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| DOI
2011 | Journal Article | LibreCat-ID: 13570
Müllegger S, Rashidi M, Lengauer T, et al. Asymmetric saddling of single porphyrin molecules on Au(111). Physical Review B. 2011;83(16). doi:10.1103/physrevb.83.165416
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2011 | Journal Article | LibreCat-ID: 13571
Thierfelder C, Witte M, Blankenburg S, Rauls E, Schmidt WG. Methane adsorption on graphene from first principles including dispersion interaction. Surface Science. 2011;605:746-749. doi:10.1016/j.susc.2011.01.012
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2011 | Journal Article | LibreCat-ID: 13823
Sanna S, Berth G, Hahn W, Widhalm A, Zrenner A, Schmidt WG. Vibrational properties of the LiNbO3 z-surfaces. IEEE Transactions on Ultrasonics, Ferroelectrics and Frequency Control. 2011;58(9):1751-1756. doi:10.1109/tuffc.2011.2012
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| DOI
2011 | Journal Article | LibreCat-ID: 13825
Sanna S, Thierfelder C, Wippermann S, Sinha TP, Schmidt WG. Barium titanate ground- and excited-state properties from first-principles calculations. Physical Review B. 2011;83(5). doi:10.1103/physrevb.83.054112
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2011 | Journal Article | LibreCat-ID: 4543
Sanna S, Berth G, Hahn W, Widhalm A, Zrenner A, Schmidt WG. Localised Phonon Modes at LiNbO3(0001) Surfaces. Ferroelectrics. 2011;419(1):1-8. doi:10.1080/00150193.2011.594396
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| DOI
2012 | Journal Article | LibreCat-ID: 15869
Wiebeler C, Tautz R, Feldmann J, von Hauff E, Da Como E, Schumacher S. Spectral Signatures of Polarons in Conjugated Co-polymers. The Journal of Physical Chemistry B. 2012:4454-4460. doi:10.1021/jp3084869
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| DOI
2012 | Journal Article | LibreCat-ID: 15872
Montgomery NA, Hedley GJ, Ruseckas A, et al. Dynamics of fluorescence depolarisation in star-shaped oligofluorene-truxene molecules. Physical Chemistry Chemical Physics. 2012. doi:10.1039/c2cp24141b
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2012 | Conference Paper | LibreCat-ID: 15985
Reuter C, Frantz M, Lauter C, Block H, Tröster T. Simulation and testing of hybrid structures consisting of press-hardened steel and CFRP. In: ; 2012.
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2012 | Conference Paper | LibreCat-ID: 15987
Lauter C, Frantz M, Kohler JP, Tröster T. Crash tests of hybrid structures consisting of sheet metal and local CFRP reinforcements. In: ; 2012.
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2012 | Journal Article | LibreCat-ID: 13531
Schmidt C, Breuer T, Wippermann S, Schmidt WG, Witte G. Substrate Induced Thermal Decomposition of Perfluoro-Pentacene Thin Films on the Coinage Metals. The Journal of Physical Chemistry C. 2012;116:24098-24106. doi:10.1021/jp307316r
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| DOI
2012 | Journal Article | LibreCat-ID: 13534
Wall S, Krenzer B, Wippermann S, et al. Atomistic Picture of Charge Density Wave Formation at Surfaces. Physical Review Letters. 2012;109(18). doi:10.1103/physrevlett.109.186101
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2012 | Journal Article | LibreCat-ID: 13535
Sanna S, Schmidt WG. Ferroelectric phase transition in LiNbO3: Insights from molecular dynamics. IEEE Transactions on Ultrasonics, Ferroelectrics and Frequency Control. 2012;59(9):1925-1928. doi:10.1109/tuffc.2012.2408
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2012 | Journal Article | LibreCat-ID: 13536
Riefer A, Sanna S, Gavrilenko AV, Schmidt WG. Linear and nonlinear optical response of LiNbO3 calculated from first principles. IEEE Transactions on Ultrasonics, Ferroelectrics, and Frequency Control. 2012;59(9):1929-1933. doi:10.1109/tuffc.2012.2409
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2012 | Journal Article | LibreCat-ID: 13538
Riefer A, Sanna S, Schmidt WG. Polarization-dependent methanol adsorption on lithium niobate Z-cut surfaces. Physical Review B. 2012;86(12). doi:10.1103/physrevb.86.125410
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2012 | Journal Article | LibreCat-ID: 13539
Rode S, Hölscher R, Sanna S, et al. Atomic-resolution imaging of the polar (0001¯) surface of LiNbO3in aqueous solution by frequency modulation atomic force microscopy. Physical Review B. 2012;86(7). doi:10.1103/physrevb.86.075468
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| DOI
2012 | Journal Article | LibreCat-ID: 13541
Landmann M, Köhler T, Köppen S, Rauls E, Frauenheim T, Schmidt WG. Fingerprints of order and disorder in the electronic and optical properties of crystalline and amorphous TiO2. Physical Review B. 2012;86(6). doi:10.1103/physrevb.86.064201
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2012 | Journal Article | LibreCat-ID: 13543
Rauls E, Schmidt WG, Pertram T, Wandelt K. Interplay between metal-free phthalocyanine molecules and Au(110) substrates. Surface Science. 2012;606:1120-1125. doi:10.1016/j.susc.2012.03.010
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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: 13546
Riefer A, Rauls E, Schmidt WG, Eberhard J, Stoll I, Mattay J. 2-Aminopyrimidine-silver(I) based organic semiconductors: Electronic structure and optical response. Physical Review B. 2012;85(16). doi:10.1103/physrevb.85.165202
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2012 | Journal Article | LibreCat-ID: 13548
Thissen P, Thissen V, Wippermann S, Chabal YJ, Grundmeier G, Schmidt WG. pH-dependent structure and energetics of H2O/MgO(100). Surface Science. 2012;606:902-907. doi:10.1016/j.susc.2012.01.018
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2012 | Journal Article | LibreCat-ID: 13560
Hölscher R, Sanna S, Schmidt WG. Adsorption of OH and H at the LiNbO3(0001) surface. physica status solidi (c). 2012;9(6):1361-1365. doi:10.1002/pssc.201100534
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2012 | Journal Article | LibreCat-ID: 13820
Schmidt WG, Wippermann S, Sanna S, Babilon M, Vollmers NJ, Gerstmann U. In-Si(111)(4 × 1)/(8 × 2) nanowires: Electron transport, entropy, and metal-insulator transition. physica status solidi (b). 2012;249(2):343-359. doi:10.1002/pssb.201100457
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2012 | Journal Article | LibreCat-ID: 3974 |
Schumacher S, Förstner J, Zrenner A, et al. Cavity-assisted emission of polarization-entangled photons from biexcitons in quantum dots with fine-structure splitting. Optics Express. 2012;20(5):5335-5342. doi:10.1364/oe.20.005335
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2012 | Journal Article | LibreCat-ID: 22953
Reichelt M, Walther A, Meier T. Tailoring the high-harmonic emission in two-level systems and semiconductors by pulse shaping. Journal of the Optical Society of America B. 2012;29(2). doi:10.1364/josab.29.000a36
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2012 | Conference Paper | LibreCat-ID: 15986
Gorny B, Hankeln F, Lauter C, et al. Simulation and manufacturing of deep drawn parts reinforced by carbon fibre prepregs. In: ; 2012.
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2013 | Book Chapter | LibreCat-ID: 18475
Riefer A, Rohrmüller M, Landmann M, et al. Lithium niobate dielectric function and second-order polarizability tensor from massively parallel ab initio calculations. In: Nagel WE, Kröner DH, Resch MM, eds. High Performance Computing in Science and Engineering ‘13. Transactions of the High Performance Computing Center, Stuttgart. Cham: Springer; 2013:93-104. doi:10.1007/978-3-319-02165-2_8
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2013 | Journal Article | LibreCat-ID: 15866
Ardizzone V, Lewandowski P, Luk MH, et al. Formation and control of Turing patterns in a coherent quantum fluid. Scientific Reports. 2013. doi:10.1038/srep03016
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2013 | Journal Article | LibreCat-ID: 15867
Tautz R, Da Como E, Wiebeler C, et al. Charge Photogeneration in Donor–Acceptor Conjugated Materials: Influence of Excess Excitation Energy and Chain Length. Journal of the American Chemical Society. 2013:4282-4290. doi:10.1021/ja309252a
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2013 | Journal Article | LibreCat-ID: 15868
Luk MH, Tse YC, Kwong NH, et al. Transverse optical instability patterns in semiconductor microcavities: Polariton scattering and low-intensity all-optical switching. Physical Review B. 2013. doi:10.1103/physrevb.87.205307
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| DOI
2013 | Journal Article | LibreCat-ID: 15870
Ling S, Schumacher S, Galbraith I, Paterson MJ. Excited-State Absorption of Conjugated Polymers in the Near-Infrared and Visible: A Computational Study of Oligofluorenes. The Journal of Physical Chemistry C. 2013:6889-6895. doi:10.1021/jp401359a
LibreCat
| DOI
2013 | Journal Article | LibreCat-ID: 13517
Jesser A, Rohrmüller M, Schmidt WG, Herres-Pawlis S. Geometrical and optical benchmarking of copper guanidine-quinoline complexes: Insights from TD-DFT and many-body perturbation theory†. Journal of Computational Chemistry. 2013;35(1-2):1-17. doi:10.1002/jcc.23449
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| DOI
2013 | Journal Article | LibreCat-ID: 13519
Riefer A, Sanna S, Schmidt WG. LiNb1-xTaxO3Electronic Structure and Optical Response fromFirst-PrinciplesCalculations. Ferroelectrics. 2013;447:78-85. doi:10.1080/00150193.2013.821904
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| DOI
2013 | Journal Article | LibreCat-ID: 13521
Sanna S, Rode S, Hölscher R, et al. Charge compensation by long-period reconstruction in strongly polar lithium niobate surfaces. Physical Review B. 2013;88. doi:10.1103/physrevb.88.115422
LibreCat
| DOI
2013 | Journal Article | LibreCat-ID: 13522
Aldahhak H, Schmidt WG, Rauls E. Adsorption of PTCDA on NaCl(100) and KCl(100). Surface Science. 2013;617:242-248. doi:10.1016/j.susc.2013.08.003
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| DOI
2013 | Journal Article | LibreCat-ID: 13525 |
Riefer A, Sanna S, Schindlmayr A, Schmidt WG. Optical response of stoichiometric and congruent lithium niobate from first-principles calculations. Physical Review B. 2013;87(19). doi:10.1103/PhysRevB.87.195208
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| WoS
2013 | Journal Article | LibreCat-ID: 13527
Rohrmüller M, Herres-Pawlis S, Witte M, Schmidt WG. Bis-μ-oxo and μ-η2:η2-peroxo dicopper complexes studied within (time-dependent) density-functional and many-body perturbation theory. Journal of Computational Chemistry. 2013;34:1035-1045. doi:10.1002/jcc.23230
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| DOI
2013 | Journal Article | LibreCat-ID: 13528
George BM, Behrends J, Schnegg A, et al. Atomic Structure of Interface States in Silicon Heterojunction Solar Cells. Physical Review Letters. 2013;110(13). doi:10.1103/physrevlett.110.136803
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