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343 Publications


2004 | Journal Article | LibreCat-ID: 13713
Palummo, M., et al. “The Bethe–Salpeter Equation: A First-Principles Approach for Calculating Surface Optical Spectra.” Journal of Physics: Condensed Matter, vol. 16, 2004, pp. S4313–22, doi:10.1088/0953-8984/16/39/006.
LibreCat | DOI
 

2004 | Journal Article | LibreCat-ID: 13715
Preuss, M., et al. “Methylchloride Adsorbed on Si(001): An Ab Initio Study.” Applied Surface Science, vol. 234, 2004, pp. 155–61, doi:10.1016/j.apsusc.2004.05.041.
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2004 | Journal Article | LibreCat-ID: 13716
Fleischer, K., et al. “Atomic Indium Nanowires on Si(111): The (4 × 1)–(8 × 2) Phase Transition Studied with Reflectance Anisotropy Spectroscopy.” Applied Surface Science, vol. 234, 2004, pp. 302–06, doi:10.1016/j.apsusc.2004.05.114.
LibreCat | DOI
 

2004 | Journal Article | LibreCat-ID: 13717
Seino, K., et al. “Energetics of Si(001) Surfaces Exposed to Electric Fields and Charge Injection.” Physical Review Letters, vol. 93, no. 3, 2004, doi:10.1103/physrevlett.93.036101.
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2004 | Journal Article | LibreCat-ID: 13718
Preuss, M., et al. “Methyl Chloride Adsorption on Si(001)−Electronic Structure.” The Journal of Physical Chemistry B, vol. 108, 2004, pp. 7809–13, doi:10.1021/jp049661z.
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2004 | Journal Article | LibreCat-ID: 13719
Seino, K., et al. “Organic Modification of Surface Electronic Properties: A First-Principles Study of Uracil on Si(001).” Physical Review B, vol. 69, 2004, p. 245309, doi:10.1103/physrevb.69.245309.
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2004 | Journal Article | LibreCat-ID: 13720
Schmidt, Wolf Gero, et al. “Calculation of Surface Optical Properties: From Qualitative Understanding to Quantitative Predictions.” Thin Solid Films, vol. 455–456, 2004, pp. 764–71, doi:10.1016/j.tsf.2003.11.263.
LibreCat | DOI
 

2004 | Journal Article | LibreCat-ID: 13721
Seino, K., and Wolf Gero Schmidt. “Reflectance Anisotropy of Uracil Covered Si(001) Surfaces: Ab Initio Predictions.” Surface Science, vol. 548, 2004, pp. 183–86, doi:10.1016/j.susc.2003.11.002.
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2004 | Journal Article | LibreCat-ID: 13722
Preuss, M., et al. “Ground- and Excited-State Properties of DNA Base Molecules from Plane-Wave Calculations Using Ultrasoft Pseudopotentials.” Journal of Computational Chemistry, vol. 25, no. 1, 2004, pp. 112–22, doi:10.1002/jcc.10372.
LibreCat | DOI
 

2004 | Journal Article | LibreCat-ID: 4272
Zeiser, Andreas, et al. “Dynamics of the Phonon-Induced Electron Transfer between Semiconductor Bulk and Surface States.” Physica Status Solidi (b), vol. 241, no. 12, Wiley, 2004, pp. R60–62, doi:10.1002/pssb.200409060.
LibreCat | Files available | DOI
 

2003 | Journal Article | LibreCat-ID: 13723
Bechstedt, F., et al. “Many-Body and Overlayer Effects on Surface Optical Properties.” Physica Status Solidi (B), vol. 240, no. 3, 2003, pp. 469–79, doi:10.1002/pssb.200303827.
LibreCat | DOI
 

2003 | Journal Article | LibreCat-ID: 13724
Pristovsek, M., et al. “Gallium-Rich Reconstructions on GaAs(001).” Physica Status Solidi (B), vol. 240, no. 1, 2003, pp. 91–98, doi:10.1002/pssb.200301885.
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2003 | Journal Article | LibreCat-ID: 13725
Lu, Wenchang, et al. “Cycloaddition Reaction versus Dimer Cleavage at TheSi(001):C5H8interface.” Physical Review B, vol. 68, 2003, p. 115327, doi:10.1103/physrevb.68.115327.
LibreCat | DOI
 

2003 | Journal Article | LibreCat-ID: 13726
Castillo, C., et al. “Layer-by-Layer Analysis of Surface Reflectance Anisotropy in Semiconductors.” Physical Review B, vol. 68, 2003, p. 041310(R), doi:10.1103/physrevb.68.041310.
LibreCat | DOI
 

2003 | Journal Article | LibreCat-ID: 13727
Wang, Shuchun, et al. “Nanowire-Induced Optical Anisotropy of the Si(111)-In Surface.” Physical Review B, vol. 68, 2003, p. 035329, doi:10.1103/physrevb.68.035329.
LibreCat | DOI
 

2003 | Journal Article | LibreCat-ID: 13728
Hahn, P. H., et al. “P-RichGaP(001)(2×1)/(2×2)Surface:  A Hydrogen-Adsorbate Structure Determined from First-Principles Calculations.” Physical Review B, vol. 68, 2003, p. 033311, doi:10.1103/physrevb.68.033311.
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2003 | Journal Article | LibreCat-ID: 13729
Schmidt, Wolf Gero, and K. Seino. “Pyrrole (C4H4NH) and Polypyrrole Functionalized  Silicon Surfaces Calculated from First Principles.” Surface Review and Letters, vol. 10, no. 2–3, 2003, pp. 221–26, doi:10.1142/s0218625x03004901.
LibreCat | DOI
 

2003 | Journal Article | LibreCat-ID: 13730
Hahn, P. H., and Wolf Gero Schmidt. “Surface Ordering of P-Rich InP(001): Hydrogen Stabilization vs Electron Correlation.” Surface Review and Letters, vol. 10, no. 2–3, 2003, pp. 163–67, doi:10.1142/s0218625x03004913.
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2003 | Journal Article | LibreCat-ID: 13731
Seino, K., et al. “Chemisorption of Pyrrole (C4H4NH) on Si(001) Calculated from First-Principles.” Surface Science, vol. 532–535, 2003, pp. 988–92, doi:10.1016/s0039-6028(03)00159-6.
LibreCat | DOI
 

2003 | Journal Article | LibreCat-ID: 13732
Seino, K., et al. “Uracil Adsorbed on Si(001):  Structure and Energetics.” The Journal of Physical Chemistry B, vol. 107, 2003, pp. 5031–35, doi:10.1021/jp0342531.
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