List of EAM publications

Akhtar MA., Hadzhieva Z., Ilyas K., Ali MS., Peukert W., Boccaccini AR.:
Facile Synthesis of Gallium (III)-Chitosan Complexes as Antibacterial Biomaterial
In: Pharmaceutics 13 (2021)
ISSN: 1999-4923
DOI: 10.3390/pharmaceutics13101702
Westhauser F., Arango Ospina M., Losch S., Wilkesmann S., Lehner B., Ali MS., Peukert W., Boccaccini AR., Fellenberg J.:
Selective and caspase-independent cytotoxicity of bioactive glasses towards giant cell tumor of bone derived neoplastic stromal cells but not to bone marrow derived stromal cells.
In: Biomaterials 275 (2021), p. 120977
ISSN: 0142-9612
DOI: 10.1016/j.biomaterials.2021.120977

Windows-Yule CRK., Mühlbauer S., Torres Cisneros LA., Nair P., Marzulli V., Pöschel T.:
Janssen effect in dynamic particulate systems
In: Physical Review E 100 (2019)
ISSN: 2470-0045
DOI: 10.1103/PhysRevE.100.022902

Eibl S., Rüde U.:
A Local Parallel Communication Algorithm for Polydisperse Rigid Body Dynamics
In: Parallel Computing 80 (2018), p. 36-48
ISSN: 0167-8191
DOI: 10.1016/j.parco.2018.10.002
Stingl M., Wein F.:
A combined parametric shape optimization and ersatz material approach
In: Structural and Multidisciplinary Optimization 57 (2018), p. 1297-1315
ISSN: 1615-147X
DOI: 10.1007/s00158-017-1812-3

Haderlein M., Güldenpfennig A., Segets D., Peukert W.:
A widely applicable tool for modeling precipitation processes
In: Computers & Chemical Engineering 98 (2017), p. 197-208
ISSN: 0098-1354
DOI: 10.1016/j.compchemeng.2016.12.007
Hou Y., Du X., Scheiner S., McMeekin DP., Wang Z., Li N., Killian M., Chen H., Richter M., Levchuk I., Schrenker N., Spiecker E., Stubhan T., Luechinger NA., Hirsch A., Schmuki P., Steinrück HP., Fink R., Halik M., Snaith HJ., Brabec C.:
A generic interface to reduce the efficiency-stability-cost gap of perovskite solar cells
In: Science (2017), p. 1-9
ISSN: 0036-8075
DOI: 10.1126/science.aao5561
Laudenbach J., Schmid D., Herziger F., Frank H., Kappes M., Muoth M., Haluska M., Hof F., Backes C., Hauke F., Hirsch A., Maultzsch J.:
Diameter dependence of the defect-induced Raman modes in functionalized carbon nanotubes
In: Carbon 112 (2017), p. 1-7
ISSN: 0008-6223
DOI: 10.1016/j.carbon.2016.10.065
Lepper M., Schmitt T., Gurrath M., Raschmann M., Zhang L., Stark MW., Hölzel H., Jux N., Meyer B., Schneider MA., Steinrück HP., Marbach H.:
Adsorption Behavior of a Cyano-Functionalized Porphyrin on Cu(111) and Ag(111): From Molecular Wires to Ordered Supramolecular Two-Dimensional Aggregates
In: Journal of Physical Chemistry C 121 (2017), p. 26361-26371
ISSN: 1932-7447
DOI: 10.1021/acs.jpcc.7b08382
Li N., Perea JD., Kassar T., Richter M., Heumüller T., Matt G., Hou Y., Güldal NS., Chen H., Chen S., Langner S., Berlinghof M., Unruh T., Brabec C.:
Abnormal strong burn-in degradation of highly efficient polymer solar cells caused by spinodal donor-acceptor demixing
In: Nature Communications 8 (2017), Article No.: 14541
ISSN: 2041-1723
DOI: 10.1038/ncomms14541
Markl M., Lodes M., Franke M., Körner C.:
Additive Fertigung durch selektives Elektronenstrahlschmelzen
In: Schweissen und Schneiden (2017), p. 30-39
ISSN: 0036-7184
Neubauer SS., Schmid B., Reller C., Guldi DM., Schmid G.:
Alkalinity Initiated Decomposition of Mediating Imidazolium Ions in High Current Density CO 2 Electrolysis
In: ChemElectroChem 4 (2017), p. 160-167
ISSN: 2196-0216
DOI: 10.1002/celc.201600461
Shyshov O., Brachvogel RC., Bachmann T., Srikantharajah R., Segets D., Hampel F., Puchta R., Von Delius M.:
Adaptive Behavior of Dynamic Orthoester Cryptands
In: Angewandte Chemie International Edition 56 (2017), p. 776-781
ISSN: 1433-7851
DOI: 10.1002/anie.201609855
Thajudeen T., Walter J., Uttinger M., Peukert W.:
A Comprehensive Brownian Dynamics-Based Forward Model for Analytical (Ultra)Centrifugation
In: Particle & Particle Systems Characterization 34 (2017), Article No.: 1600229
ISSN: 0934-0866
DOI: 10.1002/ppsc.201600229
Walter J., Gorbet G., Akdas T., Segets D., Demeler B., Peukert W.:
2D analysis of polydisperse core-shell nanoparticles using analytical ultracentrifugation
In: Analyst 142 (2017), p. 206-217
ISSN: 0003-2654
DOI: 10.1039/c6an02236g

Bajus S., Agel F., Kusche MM., Ní Bhriain N., Wasserscheid P.:
Alkali hydroxide-modified Ru/γ-Al2O3 catalysts for ammonia decomposition
In: Applied Catalysis A-General 510 (2016), p. 189-195
ISSN: 0926-860X
DOI: 10.1016/j.apcata.2015.11.024
Beims MW., Gallas J.:
Alignment of Lyapunov Vectors: A Quantitative Criterion to Predict Catastrophes?
In: Scientific Reports 6 (2016), Article No.: 37102
ISSN: 2045-2322
DOI: 10.1038/srep37102
Huber F., Altenhoff M., Will S.:
A mobile system for a comprehensive online-characterization of nanoparticle aggregates based on wide-angle light scattering and laser-induced incandescence
In: Review of Scientific Instruments 87 (2016)
ISSN: 0034-6748
DOI: 10.1063/1.4948288
Kreis O., Ryssel H., Tyrach A.:
Von den ›Ingenieuren im Wald‹ zur größten Fakultät der FAU - Strategien der Bebauungsgeschichte der Technischen Fakultät
In: Festschrift 50 Jahre Technische Fakultät der FAU, Erlangen: FAU University Press, 2016, p. 99-110
ISBN: 978-3-944057-85-9
Körner C.:
Additive manufacturing of metallic components by selective electron beam melting - A review
In: International Materials Reviews 61 (2016), p. 361-377
ISSN: 0308-4590
DOI: 10.1080/09506608.2016.1176289
Liebig JP., Göken M., Richter G., Mackovic M., Przybilla T., Spiecker E., Pierron ON., Merle B.:
A flexible method for the preparation of thin film samples for in situ TEM characterization combining shadow-FIB milling and electron beam-assisted etching
In: Ultramicroscopy 171 (2016), p. 82-88
ISSN: 0304-3991
DOI: 10.1016/j.ultramic.2016.09.004
Merklein M., Herrmann J.:
Accumulative Roll Bonding of precipitation-hardenable aluminum alloys of the 6000 series in a warm rolling process
In: Proc. ROLLING Conference 2016
Phillips KR., England GT., Sunny S., Shirman E., Shirman T., Vogel N., Aizenberg J.:
A colloidoscope of colloid-based porous materials and their uses
In: Chemical Society Reviews 45 (2016), p. 281-322
ISSN: 0306-0012
DOI: 10.1039/c5cs00533g
Ritter P., Osorio Nesme A., Delgado A.:
3D numerical simulations of passive mixing in a microchannel with nozzle-diffuser-like obstacles
In: International Journal of Heat and Mass Transfer 101 (2016), p. 1075-1085
ISSN: 0017-9310
DOI: 10.1016/j.ijheatmasstransfer.2016.05.035
URL: https://ac.els-cdn.com/S0017931016306998/1-s2.0-S0017931016306998-main.pdf?_tid=3f92b956-0764-11e8-a95c-00000aacb35f&acdnat=1517498958_2ad0326101e5e7636304398e9fde773b
Sasaki T., Hanisch FG., Deutzmann R., Sakai LY., Sakuma T., Miyamoto T., Yamamoto T., Hannappel E., Chu ML., Lanig H., Mark K.:
Functional consequence of fibulin-4 missense mutations associated with vascular and skeletal abnormalities and cutis laxa
In: Matrix Biology 56 (2016), p. 132-149
ISSN: 0945-053X
DOI: 10.1016/j.matbio.2016.06.003
Schneider J., Kollhoff F., Schindler T., Bichlmaier S., Bernardi J., Unruh T., Libuda J., Berger T., Diwald O.:
Adsorption, Ordering, and Metalation of Porphyrins on MgO Nanocube Surfaces: The Directional Role of Carboxylic Anchoring Groups
In: Journal of Physical Chemistry C 120 (2016), p. 26879-26888
ISSN: 1932-7447
DOI: 10.1021/acs.jpcc.6b08956
Späth A., TU F., Vollnhals F., Drost M., Krick Calderon S., Watts B., Fink R., Marbach H.:
Additive fabrication of nanostructures with focused soft X-rays
In: RSC Advances 6 (2016), p. 98344-98349
ISSN: 2046-2069
DOI: 10.1039/C6RA18214C
Steinrück HP., Stark MW., Ditze S., Thomann M., Lungerich D., Jux N., Marbach H.:
Reversible thermally induced phase transition in ordered domains of Co(II)-5,10,15,20-tetrakis-(3,5-di-tert-butylphenyl)-porphyrin on Cu(111)
In: Surface Science 650 (2016), p. 255-262
ISSN: 0039-6028
DOI: 10.1016/j.susc.2015.11.024
Wildner W., Drummer D.:
A fiber optic temperature sensor based on the combination of epoxy and glass particles with different thermo-optic coefficients
In: Photonic Sensors 6 (2016), p. 295-302
ISSN: 1674-9251
DOI: 10.1007/s13320-016-0328-6
Wildner W., Drummer D.:
A Fiber Optic Temperature Sensor Based on the Combination of Two Materials with Different Thermo-Optic Coefficients
In: IEEE Sensors Journal 16 (2016), p. 688 - 692
ISSN: 1530-437X
DOI: 10.1109/JSEN.2015.2488979
Zhang G., Munoz M., Etzold B.:
Accelerating Oxygen-Reduction Catalysts through Preventing Poisoning with Non-Reactive Species by Using Hydrophobic Ionic Liquids
In: Angewandte Chemie International Edition 55 (2016), p. 2257-2261
ISSN: 1433-7851
DOI: 10.1002/anie.201508338
Zhang L., Lepper M., Stark MW., Schuster R., Lungerich D., Jux N., Steinrück HP., Marbach H.:
2H-Tetrakis(3,5-di-tert-butyl)phenylporphyrin on a Cu(110) Surface: Room-Temperature Self-Metalation and Surface-Reconstruction-Facilitated Self-Assembly
In: Chemistry - A European Journal 22 (2016), p. 3347-3354
ISSN: 0947-6539
DOI: 10.1002/chem.201504214

Ahmad R., Brandl M., Distaso M., Herre P., Spiecker E., Hock R., Peukert W.:
A comprehensive study on the mechanism behind formation and depletion of Cu2ZnSnS4 (CZTS) phases
In: Crystengcomm 17 (2015), p. 6972-6984
ISSN: 1466-8033
DOI: 10.1039/c5ce00661a
Assaud L., Bochmann S., Christiansen S., Bachmann J.:
A large electrochemical setup for the anodization of aluminum towards highly ordered arrays of cylindrical nanopores
In: Review of Scientific Instruments 86 (2015)
ISSN: 0034-6748
DOI: 10.1063/1.4926746
Ferstl P., Mehl S., Arman MA., Schuler M., Toghan A., Laszlo B., Lykhach Y., Brummel O., Lundgren E., Knudsen J., Hammer L., Schneider MA., Libuda J.:
Adsorption and Activation of CO on Co3O4(111) Thin Films
In: Journal of Physical Chemistry C 119 (2015), p. 16688-16699
ISSN: 1932-7447
DOI: 10.1021/acs.jpcc.5b04145
Gotterbarm K., Späth F., Bauer U., Steinrück HP., Papp C.:
Adsorption and Reaction of SO2 on Graphene-Supported Pt Nanoclusters
In: Topics in Catalysis 58 (2015), p. 573-579
ISSN: 1022-5528
DOI: 10.1007/s11244-015-0407-8
Guo F., Li N., Fecher FW., Gasparini N., Ramírez Quiroz CO., Bronnbauer C., Hou Y., Radmilovic VV., Radmilovic VR., Spiecker E., Forberich K., Brabec C.:
A generic concept to overcome bandgap limitations for designing highly efficient multi-junction photovoltaic cells
In: Nature Communications 6 (2015), Article No.: 7730
ISSN: 2041-1723
DOI: 10.1038/ncomms8730
Görling A., Hieringer W., Nikiforidis I.:
A computational study on possible active species in nickel(II)-catalyzed 1-butene dimerization in [BMIM](+)[AlCl4](-) ionic liquid solution
In: Journal of Coordination Chemistry 68 (2015), p. 3362-3373
ISSN: 0095-8972
DOI: 10.1080/00958972.2015.1075015
Kollmer J., Tupy M., Heckel M., Sack A., Pöschel T.:
Absence of subharmonic response in vibrated granular systems under microgravity conditions
In: Physical Review Applied 3 (2015), Article No.: 024007
ISSN: 2331-7019
DOI: 10.1103/PhysRevApplied.3.024007
Lanig H., Jaeger CM., Shubina T.:
A topical collection on the occasion of Tim Clark's 65th birthday; Editorial
In: Journal of Molecular Modeling 21 (2015), p. 62
ISSN: 0948-5023
DOI: 10.1007/s00894-015-2618-0
URL: http://link.springer.com/article/10.1007%2Fs00894-015-2618-0
Li N., Brabec C.:
Air-processed polymer tandem solar cells with power conversion efficiency exceeding 10%
In: Energy and Environmental Science 8 (2015), p. 2902-2909
ISSN: 1754-5692
DOI: 10.1039/c5ee02145f
Lin W., Walter J., Burger A., Maid H., Hirsch A., Peukert W., Segets D.:
A General Approach To Study the Thermodynamics of Ligand Adsorption to Colloidal Surfaces Demonstrated by Means of Catechols Binding to Zinc Oxide Quantum Dots
In: Chemistry of Materials 27 (2015), p. 358--369
ISSN: 0897-4756
DOI: 10.1021/cm504080d
Peukert W., Hartig MAJ., Jacobsen N., Leuthold A.:
A model-based precipitation study of copper-based catalysts
In: AIChE Journal 61 (2015), p. 2104-2116
ISSN: 1547-5905
DOI: 10.1002/aic.14810
Rodler F., Schade B., Jaeger CM., Backes S., Hampel F., Boettcher C., Clark T., Hirsch A.:
Amphiphilic Perylene-Calix[4]arene Hybrids: Synthesis and Tunable Self-Assembly
In: Journal of the American Chemical Society 137 (2015), p. 3308-3317
ISSN: 0002-7863
DOI: 10.1021/ja512048t
Rösner B., Ran K., Butz B., Schmidt U., Spiecker E., Fink R.:
A microspectroscopic insight into the resistivity switching of individual Ag-TCNQ nanocrystals
In: Physical Chemistry Chemical Physics 17 (2015), p. 18278-18281
ISSN: 1463-9076
DOI: 10.1039/c5cp02207j
Schindler T., Schmiele M., Schmutzler T., Kassar T., Segets D., Peukert W., Radulescu A., Kriele A., Gilles R., Unruh T.:
A Combined SAXS/SANS Study for the in Situ Characterization of Ligand Shells on Small Nanoparticles: The Case of ZnO
In: Langmuir 31 (2015), p. 10130-10136
ISSN: 0743-7463
DOI: 10.1021/acs.langmuir.5b02198
Schindler T., Walter J., Peukert W., Segets D., Unruh T.:
In Situ Study on the Evolution of Multimodal Particle Size Distributions of ZnO Quantum Dots: Some General Rules for the Occurrence of Multimodalities
In: Journal of Physical Chemistry B 119 (2015), p. 15370-15380
ISSN: 1520-6106
DOI: 10.1021/acs.jpcb.5b08005
Stahl MS., Azimi SH., Brabec C.:
A facile one-step method to reduce surface impurities in solution-processed CuInS2 nanocrystal solar cells
In: Journal of Materials Chemistry A 3 (2015), p. 14116-14120
ISSN: 2050-7488
DOI: 10.1039/c5ta04031k
Strauß V., Margraf J., Clark T., Guldi DM.:
A carbon-carbon hybrid - immobilizing carbon nanodots onto carbon nanotubes
In: Chemical Science 6 (2015), p. 6878-6885
ISSN: 2041-6520
DOI: 10.1039/c5sc02728d
Vogel N., Retsch M., Fustin CA., Del Campo A., Jonas U.:
Advances in Colloidal Assembly: The Design of Structure and Hierarchy in Two and Three Dimensions
In: Chemical Reviews 115 (2015), p. 6265-6311
ISSN: 0009-2665
DOI: 10.1021/cr400081d
Wang Z., Eigler S., Ishii Y., Hu Y., Papp C., Lytken O., Steinrück HP., Halik M.:
A facile approach to synthesize an oxo-functionalized graphene/polymer composite for low-voltage operating memory devices
In: Journal of Materials Chemistry C 3 (2015), p. 8595-8604
ISSN: 2050-7526
DOI: 10.1039/C5TC01861G
URL: http://pubs.rsc.org/en/Content/ArticleLanding/2015/TC/C5TC01861G#!divAbstract
Weichsel U., Segets D., Janeke S., Peukert W.:
Enhanced Nucleation of Lysozyme Using Inorganic Silica Seed Particles of Different Sizes
In: Crystal Growth and Design 15 (2015), p. 3582-3593
ISSN: 1528-7483
DOI: 10.1021/cg501681g

Cubeddu A., Rauh C., Delgado A.:
3D thermo-fluid dynamic simulations of high-speed-extruded starch based products
In: Open Journal of Fluid Dynamics 4 (2014), p. 103-114
ISSN: 2165-3852
DOI: 10.4236/ojfd.2014.41008
URL: http://www.scirp.org/journal/PaperInformation.aspx?paperID=44154#.U9exMfl_sjU
Cumming BP., Turner MD., Schröder-Turk G., Debbarma S., Luther-Davies B., Gu M.:
Adaptive optics enhanced direct laser writing of high refractive index gyroid photonic crystals in chalcogenide glass
In: Optics Express 22 (2014), p. 689-698
ISSN: 1094-4087
DOI: 10.1364/OE.22.000689
Gleichweit C., Amende M., Bauer U., Schernich S., Höfert O., Lorenz MPA., Zhao W., Müller M., Koch M., Bachmann P., Wasserscheid P., Libuda J., Steinrück HP., Papp C.:
Alkyl chain length-dependent surface reaction of dodecahydro-N-alkylcarbazoles on Pt model catalysts
In: Journal of Chemical Physics 140 (2014), p. 204711
ISSN: 0021-9606
DOI: 10.1063/1.4875921
Kastner K., Margraf J., Clark T., Streb C.:
A Molecular Placeholder Strategy To Access a Family of Transition-Metal-Functionalized Vanadium Oxide Clusters
In: Chemistry - A European Journal 20 (2014), p. 12269-12273
ISSN: 0947-6539
DOI: 10.1002/chem.201403592
Leugering G., Friederich J., Steinmann P.:
Adaptive finite elements based on sensitivities for topological mesh changes
In: Control and Cybernetics 43 (2014), p. 279-306
ISSN: 0324-8569
URL: https://www.scopus.com/inward/record.uri?partnerID=HzOxMe3b&scp=85018838294&origin=inward
Litzov I., Azimi SH., Matt G., Kubis P., Stubhan T., Popov G., Brabec C.:
Accelerated degradation of Al3+ doped ZnO thin films using damp heat test
In: Organic Electronics 15 (2014), p. 569-576
ISSN: 1566-1199
DOI: 10.1016/j.orgel.2013.12.001
Merklein M., Böhm W.:
Accumulative Roll Bonding: Forming Behavior, Tailored Properties and Upscaling Approach
In: Advanced Materials Research 907 (2014), p. 3-16
ISSN: 1022-6680
DOI: 10.4028/www.scientific.net/AMR.907.3
Milicevic Z., Marrink SJ., Smith AS., Smith DM.:
Establishing conditions for simulating hydrophobic solutes in electric fields by molecular dynamics Effects of the long-range van der Waals treatment on the apparent particle mobility
In: Journal of Molecular Modeling 20 (2014), p. 3270-3279
ISSN: 1610-2940
DOI: 10.1007/s00894-014-2359-5
URL: http://link.springer.com/article/10.1007%2Fs00894-014-2359-5
Min J., Luponosov YN., Gerl A., Polinskaya MS., Peregudova SM., Dmitryakov PV., Bakirov AV., Shcherbina MA., Chvalun SN., Grigorian S., Kaush-Busies N., Ponomarenko SA., Ameri T., Brabec C.:
Alkyl Chain Engineering of Solution-Processable Star-Shaped Molecules for High-Performance Organic Solar Cells
In: Advanced Energy Materials 4 (2014), p. 1301234
ISSN: 1614-6832
DOI: 10.1002/aenm.201301234
URL: http://onlinelibrary.wiley.com/doi/10.1002/aenm.201301234/abstract
Roscher V., Licklederer M., Schumacher J., Rios GR., Hoffmann B., Christiansen S., Bachmann J.:
Accurate tuning of ordered nanotubular platinum electrodes by galvanic plating
In: Dalton Transactions 43 (2014), p. 4345-4350
ISSN: 1477-9226
DOI: 10.1039/c3dt52608a
Röckert M., Ditze S., Stark MW., Xiao J., Steinrück HP., Marbach H., Lytken O.:
Abrupt coverage-induced enhancement of the self-metalation of tetraphenylporphyrin with Cu(111)
In: Journal of Physical Chemistry C 118 (2014), p. 1661-1667
ISSN: 1932-7447
DOI: 10.1021/jp412121b
Saba M., Wilts BD., Hielscher J., Schröder-Turk G.:
Absence of circular polarisation in reflections of butterfly wing scales with chiral Gyroid structure
In: Materials Today 1 (2014), p. 1-16
ISSN: 1369-7021
Stahlhut P., Ebensperger T., Zabler S., Hanke R.:
A laboratory X-ray microscopy setup using a field emission electron source and micro-structured reflection targets
In: Nuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms 324 (2014), p. 4-10
ISSN: 0168-583X
DOI: 10.1016/j.nimb.2013.12.028
Travitzky N., Bonet A., Dermeik B., Fey T., Filbert-Demut I., Schlier L., Schlordt T., Greil P.:
Additive Manufacturing of Ceramic-Based Materials
In: Advanced Engineering Materials 16 (2014), p. 729-754
ISSN: 1438-1656
DOI: 10.1002/adem.201400097

Backes C., Hauke F., Hirsch A., Hauke F.:
Tuning the adsorption of perylene-based surfactants on the surface of single-walled carbon nanotubes
In: physica status solidi (b) 250 (2013), p. 2592-2598
ISSN: 0370-1972
DOI: 10.1002/pssb.201300109
Höfert O., Lorenz MPA., Streber R., Zhao W., Bayer A., Steinrück HP., Papp C.:
Adsorption and reaction of acetylene on clean and oxygen-precovered Pd(100) studied with high-resolution X-ray photoelectron spectroscopy
In: Journal of Chemical Physics 139 (2013), p. 164706 1-7
ISSN: 0021-9606
DOI: 10.1063/1.4825112
Jakubka F., Backes C., Gannott F., Mundloch U., Hauke F., Hirsch A., Zaumseil J.:
Mapping charge transport by electroluminescence in chirality-selected carbon nanotube networks
In: Acs Nano 7 (2013), p. 7428-7435
ISSN: 1936-0851
DOI: 10.1021/nn403419d
Kuechenmeister J., Wolff C., Busch K., Peschel U., Romanov S.:
Abandoned Functionality of Thin-Film Opal Photonic Crystals
In: Advanced Optical Materials 1 (2013), p. 952-962
ISSN: 2195-1071
DOI: 10.1002/adom.201300311
Lokteva I., Thiemann S., Gannott F., Zaumseil J.:
Ambipolar, low-voltage and low-hysteresis PbSe nanowire field-effect transistors by electrolyte gating
In: Nanoscale 5 (2013), p. 4230-4235
ISSN: 2040-3364
DOI: 10.1039/c3nr33723e
Lykhach Y., Happel M., Johanek V., Skala T., Kollhoff F., Tsud N., Dvorak F., Prince KC., Matolin V., Libuda J.:
Adsorption and Decomposition of Formic Acid on Model Ceria and Pt/Ceria Catalysts
In: Journal of Physical Chemistry C 117 (2013), p. 12483-12494
ISSN: 1932-7447
DOI: 10.1021/jp311008v
Milek T., Meyer B., Zahn D.:
A first-principles based force-field for Li+ and OH- in ethanolic solution
In: Journal of Chemical Physics 139 (2013), Article No.: 144506
ISSN: 0021-9606
DOI: 10.1063/1.4824300
Min J., Zhang H., Stubhan T., Luponosov YN., Kraft M., Ponomarenko SA., Ameri T., Scherf U., Brabec C.:
A combination of Al-doped ZnO and a conjugated polyelectrolyte interlayer for small molecule solution-processed solar cells with an inverted structure
In: Journal of Materials Chemistry A 1 (2013), p. 11306
ISSN: 2050-7488
DOI: 10.1039/c3ta12162c
URL: http://pubs.rsc.org/en/Content/ArticleLanding/2013/TA/c3ta12162c#!divAbstract
Prechtel M., Leugering G., Steinmann P., Stingl M.:
A cohesive crack propagation model: Mathematical theory and numerical solution
In: Communications on Pure and Applied Analysis 12 (2013), p. 1705-1729
ISSN: 1534-0392
DOI: 10.3934/cpaa.2013.12.1705
Turner MD., Saba M., Zhang Q., Cumming BP., Schröder-Turk G., Gu M.:
A Chiral Beamsplitter Inspired by Butterfly Nanostructures
Frontiers in Optics (Orlando, 6. October 2013 - 10. October 2013)
In: Frontiers in Optics 2013 2013
DOI: 10.1364/FIO.2013.FW6A.3
Wang Z., Mohammadzadeh S., Schmaltz T., Kirschner J., Khassanov A., Eigler S., Mundloch U., Backes C., Steinrück HP., Magerl A., Hauke F., Hirsch A., Halik M., Hauke F.:
Region-Selective Self-Assembly of Functionalized Carbon Allotropes from Solution
In: Acs Nano 7 (2013), p. 11427-11434
ISSN: 1936-0851
DOI: 10.1021/nn405488n
URL: http://pubs.acs.org/doi/abs/10.1021/nn405488n
Wheeler JM., Maier V., Durst K., Göken M., Michler J.:
Activation parameters for deformation of ultrafine-grained aluminium as determined by indentation strain rate jumps at elevated temperature
In: Materials Science and Engineering A-Structural Materials Properties Microstructure and Processing 585 (2013), p. 108-113
ISSN: 0921-5093
DOI: 10.1016/j.msea.2013.07.033

Ditze S., Stark MW., Drost M., Buchner F., Steinrück HP., Marbach H.:
Activation energy for the self-metalation reaction of 2H- tetraphenylporphyrin on Cu(111)
In: Angewandte Chemie International Edition 51 (2012), p. 10898-10901
ISSN: 1433-7851
DOI: 10.1002/anie.201205464
Greil P.:
Advancements in Polymer-Filler Derived Ceramics
In: Journal of the Korean Ceramic Society 49 (2012), p. 279-286
ISSN: 1229-7801
DOI: 10.4191/kcers.2012.49.4.279
Happel M., Myslivecek J., Johanek V., Dvorak F., Stetsovych O., Lykhach Y., Matolin V., Libuda J.:
Adsorption sites, metal-support interactions, and oxygen spillover identified by vibrational spectroscopy of adsorbed CO: A model study on Pt/ceria catalysts
In: Journal of Catalysis 289 (2012), p. 118-126
ISSN: 0021-9517
DOI: 10.1016/j.jcat.2012.01.022
Kowalski D., Schmuki P.:
Advanced Geometries of PEDOT Formed in Titania Nanotubes
In: ChemPhysChem 13 (2012), p. 3790-3793
ISSN: 1439-4235
DOI: 10.1002/cphc.201200735
Pickl K., Götz J., Iglberger K., Pande J., Mecke K., Smith AS., Rüde U.:
All good things come in threes - Three beads learn to swim with lattice Boltzmann and a rigid body solver
In: Journal of Computational Science 3 (2012), p. 374-387
ISSN: 1877-7503
DOI: 10.1016/j.jocs.2012.04.009
URL: http://arxiv.org/abs/1108.0786v1
Segets D., Lukas M., Klupp Taylor R., Scheele M., Zheng H., Alivisatos P., Peukert W.:
Determination of the quantum dot band gap dependence on particle size from optical absorbance and transmission electron microscopy measurements
In: Acs Nano 6 (2012), p. 9021-9032
ISSN: 1936-0851
DOI: 10.1021/nn303130d

Backes C., Bosch S., Mundloch U., Hauke F., Hirsch A., Hauke F.:
Density gradient ultracentrifugation on carbon nanotubes according to structural integrity as a foundation for an absolute purity evaluation
In: ChemPhysChem 12 (2011), p. 2576-2580
ISSN: 1439-4235
DOI: 10.1002/cphc.201100258
Backes C., Hauke F., Hirsch A.:
The potential of perylene bisimide derivatives for the solubilization of carbon nanotubes and graphene
In: Advanced Materials 23 (2011), p. 2588-2601
ISSN: 0935-9648
DOI: 10.1002/adma.201100300
Backes C., Schmidt C., Hauke F., Hirsch A.:
Perylene-based nanotweezers: Enrichment of larger-diameter single-walled carbon nanotubes
In: Chemistry-An Asian Journal 6 (2011), p. 438-444
ISSN: 1861-4728
DOI: 10.1002/asia.201000647
Feichtinger C., Köstler H., Hager G., Rüde U., Wellein G., Habich J.:
A flexible Patch-based lattice Boltzmann parallelization approach for heterogeneous GPU-CPU clusters
In: Parallel Computing 37 (2011), p. 536-549
ISSN: 0167-8191
DOI: 10.1016/j.parco.2011.03.005
URL: http://www.sciencedirect.com/science/article/pii/S0167819111000342
Gebhardt B., Hof F., Backes C., Müller M., Plocke T., Maultzsch J., Thomsen C., Hauke F., Hirsch A.:
Selective polycarboxylation of semiconducting single-walled carbon nanotubes by reductive sidewall functionalization
In: Journal of the American Chemical Society 133 (2011), p. 19459-19473
ISSN: 0002-7863
DOI: 10.1021/ja206818n
Kayi H., Clark T.:
AM1* parameters for palladium and silver
In: Journal of Molecular Modeling 17 (2011), p. 2585--2600
ISSN: 0948-5023
DOI: 10.1007/s00894-010-0940-0
Luckas N., Gotterbarm K., Streber R., Lorenz MPA., Höfert O., Vines F., Papp C., Görling A., Steinrück HP.:
Adsorption and reaction of SO2 on clean and oxygen precovered Pd(100) - A combined HR-XPS and DF study
In: Physical Chemistry Chemical Physics 13 (2011), p. 16227-16235
ISSN: 1463-9076
DOI: 10.1039/c1cp21694e
Merklein M., Hung Nguyen .:
Adjusting Optimized Material Properties for Tailored Heat Treated Blanks
In: Key Engineering Materials 473 (2011), p. 420-427
ISSN: 1013-9826
DOI: 10.4028/www.scientific.net/KEM.473.420
Molina-Ontoria A., Wielopolski M., Gebhardt J., Gouloumis A., Clark T., Guldi DM., Martin N.:
[2,2]Paracyclophane-Based π-Conjugated Molecular Wires Reveal Molecular-Junction Behavior
In: Journal of the American Chemical Society 133 (2011), p. 2370-2373
ISSN: 0002-7863
DOI: 10.1021/ja109745a
Santos J., Illescas BM., Martin N., Adrio J., Carretero JC., Viruela R., Orti E., Spänig F., Guldi DM.:
A Fully Conjugated TTF-π-TCAQ System: Synthesis, Structure, and Electronic Properties
In: Chemistry - A European Journal 17 (2011), p. 2957-2964
ISSN: 0947-6539
DOI: 10.1002/chem.201002674
Schmid M., Hieringer W., Schmitz CH., Steinrück HP., Sokolowski M., Gottfried M.:
Adsorption and reaction of terephthaloyl chloride on Ag(111): X-ray photoelectron spectroscopy and density functional theory investigations
In: Journal of Physical Chemistry C 115 (2011), p. 14869-14875
ISSN: 1932-7447
DOI: 10.1021/jp2033017
Schmidt C., Knieke C., Maier V., Höppel HW., Peukert W., Göken M.:
Accelerated grain refinement during accumulative roll bonding by nanoparticle reinforcement
In: Scripta Materialia 64 (2011), p. 245--248
ISSN: 1359-6462
DOI: 10.1016/j.scriptamat.2010.10.013
Schmidt C., Lang N., Jux N., Hirsch A.:
A facile route to water-soluble coronenes and benzo[ghi]perylenes
In: Chemistry - A European Journal 17 (2011), p. 5289-5299
ISSN: 0947-6539
DOI: 10.1002/chem.201003232
Teichmann D., Arlt W., Wasserscheid P., Freymann R.:
A future energy supply based on Liquid Organic Hydrogen Carriers (LOHC)
In: Energy and Environmental Science 4 (2011), p. 2767
ISSN: 1754-5692
DOI: 10.1039/C1EE01454D

Arns CH., Knackstedt MA., Mecke K.:
3D structural analysis: sensitivity of Minkowski functionals
In: Journal of Microscopy 240 (2010), p. 181-196
ISSN: 0022-2720
DOI: 10.1111/j.1365-2818.2010.03395.x
Backes C., Englert J., Bernhard N., Hauke F., Hirsch A., Hauke F.:
Optical visualization of carbon nanotubes-a unifying linkage between microscopic and spectroscopic characterization techniques
In: Small 6 (2010), p. 1968-1973
ISSN: 1613-6829
DOI: 10.1002/smll.201001019
Backes C., Hirsch A.:
Noncovalent Functionalization of Carbon Nanotubes
John Wiley & Sons, Ltd., 2010
DOI: 10.1002/9780470660188.ch1
Backes C., Karabudak E., Schmidt C., Hauke F., Hirsch A., Wohlleben W.:
Determination of the surfactant density on SWCNTs by analytical ultracentrifugation
In: Chemistry - A European Journal 16 (2010), p. 13176-13184
ISSN: 0947-6539
DOI: 10.1002/chem.200903461
Backes C., Mundloch U., Ebel A., Hauke F., Hirsch A.:
Dispersion of HiPco® and CoMoCAT®single-walled nanotubes (SWNTs) by water soluble pyrene derivatives-depletion of small diameter SWNTs
In: Chemistry - A European Journal 16 (2010), p. 3314-3317
ISSN: 0947-6539
DOI: 10.1002/chem.200903420
Backes C., Mundloch U., Schmidt C., Coleman JN., Wohlleben W., Hauke F., Hirsch A.:
Enhanced adsorption affinity of anionic perylene-based surfactants towards smaller-diameter SWCNTs
In: Chemistry - A European Journal 16 (2010), p. 13185-13192
ISSN: 0947-6539
DOI: 10.1002/chem.201000232
Backes C., Schmidt C., Rosenlehner K., Hauke F., Hirsch A., Coleman JN.:
Nanotube surfactant design: The versatility of water-soluble perylene bisimides
In: Advanced Materials 22 (2010), p. 788-802
ISSN: 0935-9648
DOI: 10.1002/adma.200902525
Giancane G., Ruland A., Sgobba V., Manno D., Serra A., Farinola GM., Omar OH., Guldi DM., Valli L.:
Aligning Single-Walled Carbon Nanotubes By Means Of Langmuir-Blodgett Film Deposition: Optical, Morphological, and Photo-electrochemical Studies
In: Advanced Functional Materials 20 (2010), p. 2481--2488
ISSN: 1616-301X
DOI: 10.1002/adfm.201000290
Guldi DM., Feng L., Radhakrishnan SG., Nikawa H., Yamada M., Mizorogi N., Tsuchiya T., Akasaka T., Nagase S., Angeles Herranz M., Martin N.:
A molecular Ce2@ih-C80 switch-unprecedented oxidative pathway in photoinduced charge transfer reactivity
In: Journal of the American Chemical Society 132 (2010), p. 9078-9086
ISSN: 0002-7863
DOI: 10.1021/ja101856j
Karabudak E., Backes C., Hauke F., Schmidt C., Cölfen H., Hirsch A., Wohlleben W.:
A Universal Ultracentrifuge Spectrometer Visualizes CNT-Intercalant-Surfactant Complexes
In: ChemPhysChem 11 (2010), p. 3224-3227
ISSN: 1439-4235
DOI: 10.1002/cphc.201000504
Kayi H.:
AM1* parameters for gold
In: Journal of Molecular Modeling 16 (2010), p. 1029-1038
ISSN: 1610-2940
DOI: 10.1007/s00894-009-0613-z
Kayi H., Clark T.:
AM1* parameters for cobalt and nickel
In: Journal of Molecular Modeling 16 (2010), p. 29--47
ISSN: 1610-2940
DOI: 10.1007/s00894-009-0503-4
Kayi H., Clark T.:
AM1* parameters for manganese and iron
In: Journal of Molecular Modeling 16 (2010), p. 1109--1126
ISSN: 1610-2940
DOI: 10.1007/s00894-009-0614-y
Körmer R., Jank M., Ryssel H., Schmid HJ., Peukert W.:
Aerosol synthesis of silicon nanoparticles with narrow size distribution-Part 1: Experimental investigations
In: Journal of Aerosol Science 41 (2010), p. 998--1007
ISSN: 0021-8502
DOI: 10.1016/j.jaerosci.2010.05.007
Körmer R., Schmid HJ., Peukert W.:
Aerosol synthesis of silicon nanoparticles with narrow size distribution-Part 2: Theoretical analysis of the formation mechanism
In: Journal of Aerosol Science 41 (2010), p. 1008--1019
ISSN: 0021-8502
DOI: 10.1016/j.jaerosci.2010.08.002
Mergheim J., Steinmann P., Ricker S., Müller R.:
A Comparison of Different Approaches in the Multi-Scale Computation of Configurational Forces
In: International Journal of Fracture (2010), p. accepted
ISSN: 0376-9429
DOI: 10.1007/s10704-010-9525-2
Müller MK., Luding S., Pöschel T.:
Force statistics and correlations in dense granular packings
In: Chemical Physics 375 (2010), p. 600-605
ISSN: 0301-0104
DOI: 10.1016/j.chemphys.2010.07.020
Pitonak M., Heßelmann A.:
Accurate Intermolecular Interaction Energies from a Combination of MP2 and TDDFT Response Theory
In: Journal of Chemical Theory and Computation 6 (2010), p. 168-178
ISSN: 1549-9618
DOI: 10.1021/ct9005882
Ritter D., Stürmer M., Rüde U.:
A fast-adaptive composite grid algorithm for solving the free-space Poisson problem on the cell broadband engine
In: Numerical Linear Algebra With Applications 17 (2010), p. 291-305
ISSN: 1070-5325
DOI: 10.1002/nla.697
URL: http://onlinelibrary.wiley.com/doi/10.1002/nla.703/pdf
Zahn D.:
A Molecular Rationale of Shock Absorption and Self-Healing in a Biomimetic Apatite-Collagen Composite under Mechanical Load
In: Angewandte Chemie International Edition 49 (2010), p. 9405-9407
ISSN: 1433-7851
DOI: 10.1002/anie.201002663

Backes C., Hauke F., Schmidt C., Hirsch A.:
Fractioning HiPco and CoMoCAT SWCNTs via density gradient ultracentrifugation by the aid of a novel perylene bisimide derivative surfactant
In: Chemical Communications (2009), p. 2643-2645
ISSN: 1359-7345
DOI: 10.1039/b818141a
Backes C., Schmidt C., Hauke F., Böttcher C., Hirsch A., Hauke F.:
High population of individualized SWCNTs through the adsorption of water-soluble perylenes
In: Journal of the American Chemical Society 131 (2009), p. 2172-2184
ISSN: 0002-7863
DOI: 10.1021/ja805660b
Carper WR., Langenwalter K., Nooruddin NS., Kullman MJ., Gerhard D., Wasserscheid P.:
Aggregation Models of Potential Cyclical Trimethylsulfonium Dicyanamide Ionic Liquid Clusters
In: Journal of Physical Chemistry B 113 (2009), p. 2031--2041
ISSN: 1520-6106
DOI: 10.1021/jp809215z
Ehli C., Oelsner C., Guldi DM., Mateo-Alonso A., Prato M., Schmidt C., Backes C., Hauke F., Hirsch A., Hauke F.:
Manipulating single-wall carbon nanotubes by chemical doping and charge transfer with perylene dyes
In: Nature Chemistry 1 (2009), p. 243-249
ISSN: 1755-4330
DOI: 10.1038/nchem.214
Geiger M., Merklein M., Vogt U.:
Aluminum tailored heat treated blanks
In: Production Engineering 3 (2009), p. 401-410
ISSN: 0944-6524
DOI: 10.1007/s11740-009-0179-8
Javili A., Steinmann P.:
A Finite Element Framework for Continua with Boundary Energies. Part I: The Two-Dimensional Case
In: Computer Methods in Applied Mechanics and Engineering 198 (2009), p. 2198-2208
ISSN: 0045-7825
DOI: 10.1016/j.cma.2009.02.008
Kayi H., Clark T.:
AM1* parameters for bromine and iodine
In: Journal of Molecular Modeling 15 (2009), p. 295--308
ISSN: 1610-2940
DOI: 10.1007/s00894-008-0419-4
Kayi H., Clark T.:
AM1* parameters for vanadium and chromium
In: Journal of Molecular Modeling 15 (2009), p. 1253--1269
ISSN: 1610-2940
DOI: 10.1007/s00894-009-0489-y
Schmidt MA., Granzow N., Da N., Peng M., Wondraczek L., Russell PSJ.:
All-solid bandgap guiding in tellurite-filled silica photonic crystal fibers
In: Optics Letters 34 (2009), p. 1946-1948
ISSN: 0146-9592
DOI: 10.1364/OL.34.001946
Schulz P., Schneiders K., Wasserscheid P.:
Aggregation behaviour of chiral ionic liquids
In: Tetrahedron-Asymmetry 20 (2009), p. 2479-2481
ISSN: 0957-4166
DOI: 10.1016/j.tetasy.2009.10.010
Song Y., Schmidt-Stein F., Bauer S., Schmuki P.:
Amphiphilic TiO2 Nanotube Arrays: An Actively Controllable Drug Delivery System
In: Journal of the American Chemical Society 131 (2009), p. 4230-4232
ISSN: 0002-7863
DOI: 10.1021/ja810130h

Desikusumastuti A., Staudt T., Happel M., Laurin M., Libuda J.:
Adsorption and reaction of NO2 on ordered alumina films and mixed baria-alumina nanoparticles: Cooperative versus non-cooperative reaction mechanisms
In: Journal of Catalysis 260 (2008), p. 315-328
ISSN: 0021-9517
DOI: 10.1016/j.jcat.2008.09.020
Rusu CF., Lanig H., Othersen O., Kryschi C., Clark T.:
Monitoring biological membrane-potential changes: A CI QM/MM study
In: Journal of Physical Chemistry B 112 (2008), p. 2445-2455
ISSN: 1520-6106
DOI: 10.1021/jp075372+
Vines Solana F., Desikusumastuti A., Staudt T., Görling A., Libuda J., Neyman KM.:
A combined density-functional and IRAS study on the interaction of NO with Pd nanoparticles: Identifying new adsorption sites with novel properties
In: Journal of Physical Chemistry C 112 (2008), p. 16539-16549
ISSN: 1932-7447
DOI: 10.1021/jp804315c

Einsiedel J., Lanig H., Waibel R., Gmeiner P.:
Molecular Building Kit of Fused-Proline-Derived Peptide Mimetics Allowing Specific Adjustment of the Dihedral Psi Angle
In: Journal of Organic Chemistry 72 (2007), p. 9102-9113
ISSN: 0022-3263
DOI: 10.1021/jo701703e

List of EAM publications

List of EAM publications

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