Ab initio derived force‐field parameters for molecular dynamics simulations of deprotonated amorphous‐SiO2 /water interfacesA Butenuth, G Moras, J Schneider, M Koleini, S Köppen, R Meißner, ...
physica status solidi (b) 249 (2), 292-305, 2012
80 2012 Fingerprints of order and disorder in the electronic and optical properties of crystalline and amorphous TiO M Landmann, T Köhler, S Köppen, E Rauls, T Frauenheim, WG Schmidt
Physical Review B 86 (6), 064201, 2012
78 2012 Adsorption of small organic molecules on anatase and rutile surfaces: a theoretical study S Köppen, W Langel
Physical Chemistry Chemical Physics 10 (14), 1907-1915, 2008
74 2008 Simulation of the interface of (1 0 0) rutile with aqueous ionic solution S Köppen, W Langel
Surface science 600 (10), 2040-2050, 2006
57 2006 The role of surface functionalization of colloidal alumina particles on their controlled interactions with viruses F Meder, J Wehling, A Fink, B Piel, K Li, K Frank, A Rosenauer, L Treccani, ...
Biomaterials 34 (17), 4203-4213, 2013
40 2013 Adsorption of collagen fragments on titanium oxide surfaces: A molecular dynamics study S Köppen, B Ohler, W Langel
Zeitschrift für Physikalische Chemie 221 (1), 3-20, 2007
35 2007 Lysine residues control the conformational dynamics of beta 2-glycoprotein I I Buchholz, P Nestler, S Köppen, M Delcea
Physical Chemistry Chemical Physics 20 (42), 26819-26829, 2018
25 2018 Label-free biosensing with single-molecule force spectroscopy G Wei, S Steckbeck, S Köppen, LC Ciacchi
Chemical Communications 49 (31), 3239-3241, 2013
24 2013 Atomistic Simulations of the ZnO (12̅10)/Water Interface: A Comparison between First-Principles, Tight-Binding, and Empirical Methods. SH Große, S Köppen, T Frauenheim, LC Colombi
Journal of chemical theory and computation 8 (11), 4517-4526, 2012
24 2012 Titanium binding dodecapeptides and the impact of water structure W Friedrichs, S Köppen, W Langel
Surface Science 617, 42-52, 2013
19 2013 Adsorption of Collagen Nanofibrils on Rough TiO2 : A Molecular Dynamics Study W Friedrichs, B Ohler, W Langel, S Monti, S Köppen
Advanced Engineering Materials 13 (10), B334-B342, 2011
17 2011 Physisorption of α-chymotrypsin on SiO2 and TiO2 : A comparative study via experiments and molecular dynamics simulations L Derr, N Hildebrand, S Köppen, S Kunze, L Treccani, R Dringen, ...
Biointerphases 11 (1), 011007, 2016
16 2016 Simulated and experimental force spectroscopy of lysozyme on silica N Hildebrand, G Wei, S Köppen, LC Ciacchi
Physical Chemistry Chemical Physics 20 (29), 19595-19605, 2018
12 2018 Creation of models and parametrization of a classical force field for amorphous Al2O3/water interfaces based on Density Functional Theory S Lid, S Köppen, LC Ciacchi
Computational Materials Science 140, 307-314, 2017
12 2017 Molecular dynamics simulations of the amino acid-ZnO (10-10) interface: A comparison between density functional theory and density functional tight binding results S Grosse Holthaus, S Köppen, T Frauenheim, LC Ciacchi
The Journal of chemical physics 140 (23), 234707, 2014
12 2014 The role of water co-adsorption on the modification of ZnO nanowires using acetic acid A Domínguez, S grosse Holthaus, S Köppen, T Frauenheim, AL da Rosa
Physical Chemistry Chemical Physics 16 (18), 8509-8514, 2014
11 2014 Nanoscale Properties of Solid–Liquid Interfaces L Colombi Ciacchi, S Köppen
Encyclopedia of Nanotechnology, 1728-1733, 2012
2 2012 
Walter LangelProfessor for biophysical chemistry, university of GreifswaldEmail verificata su uni-greifswald.de
