K. Seino, S. Sanna, and W. G. Schmidt, “Temperature stabilizes rough Au/Ge(001) surface reconstructions,” Surface Science, vol. 667, pp. 101–104, 2018.

H. Aldahhak, W. G. Schmidt, and E. Rauls, “Single PTCDA molecules on planar and stepped KCl and NaCl(100) surfaces,” Surface Science, pp. 278–281, 2015.

H. Aldahhak, E. Rauls, and W. G. Schmidt, “Diindenoperylene adsorption on Cu(111) studied with density-functional theory,” Surface Science, pp. 260–265, 2015.

A. Baghbanpourasl et al., “Water adsorbate influence on the Cu(110) surface optical response,” Surface Science, vol. 641, pp. 231–236, 2015.

H. Aldahhak, W. G. Schmidt, and E. Rauls, “Adsorption of PTCDA on NaCl(100) and KCl(100),” Surface Science, vol. 617, pp. 242–248, 2013.

E. Rauls, W. G. Schmidt, T. Pertram, and K. Wandelt, “Interplay between metal-free phthalocyanine molecules and Au(110) substrates,” Surface Science, vol. 606, pp. 1120–1125, 2012.

P. Thissen, V. Thissen, S. Wippermann, Y. J. Chabal, G. Grundmeier, and W. G. Schmidt, “pH-dependent structure and energetics of O/MgO(100),” Surface Science, vol. 606, pp. 902–907, 2012.

P. P. Favero, A. C. Ferraz, W. G. Schmidt, and R. Miotto, “Driving forces for the adsorption of cyclopentene on InP(001),” Surface Science, vol. 605, pp. 824–830, 2011.

C. Thierfelder, M. Witte, S. Blankenburg, E. Rauls, and W. G. Schmidt, “Methane adsorption on graphene from first principles including dispersion interaction,” Surface Science, vol. 605, pp. 746–749, 2011.

B. Lange et al., “Water adsorption on hydrogenated Si(111) surfaces,” Surface Science, vol. 603, pp. 60–64, 2009.

S. Wippermann and W. G. Schmidt, “Optical anisotropy of the In/Si(111)(4×1)/(8×2) nanowire array,” Surface Science, vol. 603, pp. 247–250, 2008.

E. Rauls, S. Blankenburg, and W. G. Schmidt, “DFT calculations of adenine adsorption on coin metal (110) surfaces,” Surface Science, vol. 602, pp. 2170–2174, 2008.

B. Lange and W. G. Schmidt, “Ammonia adsorption on Cl/Si(001): First-principles calculations,” Surface Science, vol. 602, pp. 1207–1211, 2008.

S. Wippermann et al., “Quantum conductance of In nanowires on Si(111) from first principles calculations,” Surface Science, pp. 4045–4047, 2007.

K. Seino and W. G. Schmidt, “Conformation-selective adsorption of 2,3-butanediol on Si(001),” Surface Science, pp. 191–196, 2005.

K. Seino and W. G. Schmidt, “O on Si(001): surface optical anisotropy from first-principles calculations,” Surface Science, vol. 571, no. 157, pp. 157–160, 2004.

K. Seino and W. G. Schmidt, “Reflectance anisotropy of uracil covered Si(001) surfaces: Ab initio predictions,” Surface Science, vol. 548, pp. 183–186, 2004.

P. Baumann, G. Pirug, D. Reuter, and H. P. Bonzel, “UHV adsorption studies of K/O on Pt(111) and O/CCOOH on Cu(110): orientation and intermediates,” Surface Science, pp. 186–196, 2003.

K. Seino, W. G. Schmidt, J. Furthmüller, and F. Bechstedt, “Chemisorption of pyrrole (NH) on Si(001) calculated from first-principles,” Surface Science, vol. 532–535, pp. 988–992, 2003.

M. G. Garnier, M. T. de los Arcos de Pedro, J. Boudaden, and P. Oelhafen, “Photoemission study of the iron-induced chemical reduction of silicon native oxide,”10.1016/s0039-6028(03)00581-8__Surface Science, pp. 130–138, 2003, doi:10.1016/s0039-6028(03)00581-8 .

D. Sander, A. Enders, C. Schmidthals, D. Reuter, and J. Kirschner, “Mechanical stress and magnetism of ferromagnetic monolayers,” Surface Science, pp. 351–355, 2002.

A. Wiessner, M. Agne, D. Reuter, and J. Kirschner, “Formation of copper crystallites on a Cu/Fe/Cu(100) sandwich,” Surface Science, pp. 937–942, 2002.

K. Seino, W. G. Schmidt, F. Bechstedt, and J. Bernholc, “Structure and energetics of Ga-rich GaAs() surfaces,” Surface Science, vol. 507–510, pp. 406–410, 2002.

O. Pulci, K. Lüdge, W. G. Schmidt, and F. Bechstedt, “First-principles study of (2×1) and (2×2) phosphorus-rich InP(001) surfaces,” Surface Science, vol. 464, pp. 272–282, 2000.

W. G. Schmidt and F. Bechstedt, “Geometry and electronic structure of InP(001)(2×4) reconstructions,” Surface Science, vol. 409, no. 3, pp. 474–484, 1998.

U. Großner, W. G. Schmidt, F. Bechstedt, P. V. Santos, B. Koopmans, and N. Esser, “Chemisorption of arsenic on InP(110),” Surface Science, vol. 377–379, pp. 619–622, 1997.

W. G. Schmidt and F. Bechstedt, “Comparison of As-rich and Sb-terminated GaAs(100)(2 × 4) reconstructions,” Surface Science, vol. 377–379, pp. 11–14, 1997.

W. G. Schmidt and F. Bechstedt, “Atomic structures of GaAs(100)-(2 × 4) reconstructions,” Surface Science, vol. 360, no. 1, pp. L473–L477, 1996.

W. G. Schmidt, P. Käckell, and F. Bechstedt, “d core-level shifts at,” Surface Science, vol. 357–358, pp. 545–549, 1996.

W. G. Schmidt, F. Bechstedt, and G. P. Srivastava, “Phonons at III–V (110) surfaces,” Surface Science, vol. 352–354, pp. 83–88, 1996.

W. G. Schmidt, A. Scholze, and F. Bechstedt, “Dimerized, buckled, or ideal chains on the diamond (111)2 × 1 surface?,” Surface Science, vol. 351, pp. 183–188, 1996.

W. G. Schmidt and F. Bechstedt, “Se/GaAs(110): energetics and structure,” Surface Science, vol. 331–333, no. Part A, pp. 557–563, 1995.

C. Kress, M. Fiedler, W. G. Schmidt, and F. Bechstedt, “Quasi-particle band structure of C(111)2 × 1 and C(100)2 × 1 surfaces,” Surface Science, vol. 331–333, pp. 1152–1156, 1995.

W. G. Schmidt and G. P. Srivastava, “III-V(110)/Sb(1 ML): structural and dynamical properties,” Surface Science, vol. 331–333, no. Part A, pp. 540–545, 1995.

W. G. Schmidt, B. Wenzien, and F. Bechstedt, “Coverage-dependent bonding of Sb on GaAs (110),” Surface Science, vol. 307–309, no. Part A, pp. 235–240, 1994.