Please note that LibreCat no longer supports Internet Explorer versions 8 or 9 (or earlier).

We recommend upgrading to the latest Internet Explorer, Google Chrome, or Firefox.

1252 Publications


2022 | Journal Article | LibreCat-ID: 29790 | OA
Stimulation and Enhancement of Near‐Band‐Edge Emission in Zinc Oxide by Distributed Bragg Reflectors
L. Kothe, M. Albert, C. Meier, T. Wagner, M. Tiemann, Advanced Materials Interfaces (2022).
LibreCat | DOI | Download (ext.)
 

2022 | Journal Article | LibreCat-ID: 35707 | OA
The role of sulfonate groups and hydrogen bonding in the proton conductivity of two coordination networks
A. Javed, F. Steinke, S. Wöhlbrandt, H. Bunzen, N. Stock, M. Tiemann, Beilstein Journal of Nanotechnology 13 (2022) 437–443.
LibreCat | DOI | Download (ext.)
 

2022 | Journal Article | LibreCat-ID: 33691
Challenges in the interpretation of gas core levels for the determination of gas-solid interactions within dielectric porous films by ambient pressure XPS
T. de los Arcos, C. Weinberger, F. Zysk, V. Raj Damerla, S. Kollmann, P. Vieth, M. Tiemann, T. Kühne, G. Grundmeier, Applied Surface Science 604 (2022).
LibreCat | DOI
 

2022 | Journal Article | LibreCat-ID: 33685 | OA
The Structure of Water in Silica Mesopores – Influence of the Pore Wall Polarity
C. Weinberger, F. Zysk, M. Hartmann, N. Kaliannan, W. Keil, T. Kühne, M. Tiemann, Advanced Materials Interfaces 9 (2022).
LibreCat | DOI | Download (ext.)
 

2022 | Journal Article | LibreCat-ID: 29376
Pyrolysis of sucrose-derived hydrochar
M. Wortmann, W. Keil, B. Brockhagen, J. Biedinger, M. Westphal, C. Weinberger, E. Diestelhorst, W. Hachmann, Y. Zhao, M. Tiemann, G. Reiss, B. Hüsgen, C. Schmidt, K. Sattler, N. Frese, Journal of Analytical and Applied Pyrolysis 161 (2022).
LibreCat | DOI
 

2022 | Journal Article | LibreCat-ID: 28254 | OA
Porous SiO2 coated dielectric metasurface with consistent performance independent of environmental conditions
R. Geromel, C. Weinberger, K. Brormann, M. Tiemann, T. Zentgraf, Optical Materials Express 12 (2022) 13–21.
LibreCat | DOI | Download (ext.)
 

2022 | Journal Article | LibreCat-ID: 33965 | OA
Electrochemical performance of KTiOAsO_4 (KTA) in potassium-ion batteries from density-functional theory
A. Bocchini, U. Gerstmann, T. Bartley, H.-G. Steinrück, G. Henkel, W.G. Schmidt, Phys. Rev. Materials 6 (2022) 105401.
LibreCat | Files available | DOI | Download (ext.)
 

2022 | Journal Article | LibreCat-ID: 40154
FeMn with Phases of a Degradable Ag Alloy for Residue-Free and Adapted Bioresorbability
J.T. Krüger, K.-P. Hoyer, J. Huang, V. Filor, R.H. Mateus-Vargas, H. Oltmanns, J. Meißner, G. Grundmeier, M. Schaper, Journal of Functional Biomaterials 13 (2022) 185.
LibreCat | DOI
 

2022 | Journal Article | LibreCat-ID: 34652
Enhancement of the delamination resistance of adhesive film coated surface laser melted aluminum 7075-T6 alloy by aminophosphonic acid adsorption
P. Vieth, M.-A. Garthe, D. Voswinkel, M. Schaper, G. Grundmeier, Surface and Coatings Technology 447 (2022).
LibreCat | DOI
 

2022 | Journal Article | LibreCat-ID: 30103
Influence of proteins on the corrosion of a conventional and selective laser beam melted FeMn alloy in physiological electrolytes
J. Huang, A.G. Orive, J.T. Krüger, K.-P. Hoyer, A. Keller, G. Grundmeier, Corrosion Science 200 (2022) 110186.
LibreCat | DOI
 

2022 | Journal Article | LibreCat-ID: 34654
Microstructure and corrosion properties of PBF-LB produced carbide nanoparticles additivated AlSi10Mg parts
I.M. Kusoglu, P. Vieth, S. Heiland, F. Huber, A. Lüddecke, A.R. Ziefuss, A. Kwade, M. Schmidt, M. Schaper, S. Barcikowski, G. Grundmeier, Procedia CIRP 111 (2022) 10–13.
LibreCat | DOI
 

2022 | Conference Abstract | LibreCat-ID: 44376
Development of Battery System Based on Na-S and Characterization Using X-ray Absorption Spectroscopy
G. Tonbul, J. Kappler, S. Murugan, R. Schoch, M. Nowakowski, P. Lange, M. Bauer, M.R. Buchmeiser, in: Edinburgh, 2022.
LibreCat
 

2022 | Journal Article | LibreCat-ID: 45007 LibreCat | DOI
 

2022 | Journal Article | LibreCat-ID: 45010
Transferable Deep Learning Potential Reveals Intermediate-Range Ordering Effects in LiF–NaF–ZrF4 Molten Salt
R. Chahal, S. Roy, M. Brehm, S. Banerjee, V. Bryantsev, S. Lam, JACS Au 2 (12) (2022) 2693–2702.
LibreCat | DOI
 

2022 | Journal Article | LibreCat-ID: 45008
Conformer Weighting and Differently Sized Cluster Weighting for Nicotine and its Phosphorus Derivatives
S. Taherivardanjani, J. Blasius, M. Brehm, R. Dötzer, B. Kirchner, J. Phys. Chem. A 126 (40) (2022) 7070–7083.
LibreCat | DOI
 

2022 | Journal Article | LibreCat-ID: 45009
Cluster Analysis in Liquids: A Novel Tool in TRAVIS
T. Frömbgen, J. Blasius, V. Alizadeh, A. Chaumont, M. Brehm, B. Kirchner, J. Chem. Inf. Model. 62 (22) (2022) 5634–5644.
LibreCat | DOI
 

2022 | Journal Article | LibreCat-ID: 33834
A mechanistic study of the dopant-induced breakdown in halide perovskites using solid state energy storage devices
A.G.M. Mathieson, W.M. Dose, H.-G. Steinrück, C.J. Takacs, S. Feldmann, R. Pandya, A.J. Merryweather, D. Mackanic, A. Rao, F. Deschler, M. De Volder, Energy & Environmental Science 15 (2022) 4323–4337.
LibreCat | DOI
 

2022 | Preprint | LibreCat-ID: 32404
CP2K on the road to exascale
T. Kühne, C. Plessl, R. Schade, O. Schütt, ArXiv:2205.14741 (2022).
LibreCat | Download (ext.) | arXiv
 

2022 | Journal Article | LibreCat-ID: 33684 | OA
Towards electronic structure-based ab-initio molecular dynamics simulations with hundreds of millions of atoms
R. Schade, T. Kenter, H. Elgabarty, M. Lass, O. Schütt, A. Lazzaro, H. Pabst, S. Mohr, J. Hutter, T. Kühne, C. Plessl, Parallel Computing 111 (2022).
LibreCat | DOI | Download (ext.)
 

2022 | Journal Article | LibreCat-ID: 46479
Oxidation stability of chromium aluminum oxynitride hard coatings
K. Bobzin, C. Kalscheuer, G. Grundmeier, S. Kollmann, M. Carlet, M.T. de los Arcos de Pedro, Surface and Coatings Technology 449 (2022).
LibreCat | DOI
 

2022 | Conference Paper | LibreCat-ID: 35830
Modeling-based learning about chemical phenomena in primary education
J. Elsner, C. Tenberge, S. Fechner, in: G.S. Carvalho, A.S. Afonso, Z. Anastácio (Eds.), Fostering Scientific Citizenship in an Uncertain World (Proceedings of ESERA 2021), CIEC, University of Minho, Braga, n.d., pp. 1241–1249.
LibreCat
 

2022 | Conference Paper | LibreCat-ID: 33559
Analogien zur Förderung schülerseitigen Modellierens im Sachunterricht
J. Elsner, C. Tenberge, S. Fechner, in: S. Habig, H. van Vorst (Eds.), Unsicherheit als Element von naturwissenschaftsbezogenen Bildungsprozessen, 2022, pp. 500–503.
LibreCat
 

2022 | Journal Article | LibreCat-ID: 40987
Quality or Quantity? How Structural Parameters Affect Catalytic Activity of Iron Oxides for CO Oxidation
S. Schlicher, N. Prinz, J. Bürger, A. Omlor, C. Singer, M. Zobel, R. Schoch, J.K.N. Lindner, V. Schünemann, S. Kureti, M. Bauer, Catalysts 12 (2022).
LibreCat | DOI
 

2022 | Journal Article | LibreCat-ID: 43021
Electrografting of BTSE: Zn films for advanced steel-aluminum joining by plastic deformation
B. Duderija, A. González-Orive, H.C. Schmidt, J.C. Calderón, I. Hordych, H.J. Maier, W. Homberg, G. Grundmeier, Journal of Advanced Joining Processes 7 (2022).
LibreCat | DOI
 

2022 | Journal Article | LibreCat-ID: 32283
Untersuchung von Klebverbindungen für Batteriegehäuse
T. Schmolke, G. Meschut, F. Rieker, D. Meinderink, G. Grundmeier, adhäsion KLEBEN & DICHTEN 66 (2022) 40–43.
LibreCat | DOI
 

2022 | Journal Article | LibreCat-ID: 40986
High resolution off resonant spectroscopy as a probe of the oxidation state
M. Nowakowski, A. Kalinko, J. Szlachetko, R. Fanselow, M. Bauer, Journal of Analytical Atomic Spectrometry 37 (2022) 2383–2391.
LibreCat | DOI
 

2022 | Journal Article | LibreCat-ID: 40988
Digitization in Catalysis Research: Towards a Holistic Description of a Ni/Al2O3 Reference Catalyst for CO2 Methanation
S. Weber, R.T. Zimmermann, J. Bremer, K.L. Abel, D. Poppitz, N. Prinz, J. Ilsemann, S. Wendholt, Q. Yang, R. Pashminehazar, F. Monaco, P. Cloetens, X. Huang, C. Kübel, E. Kondratenko, M. Bauer, M. Bäumer, M. Zobel, R. Gläser, K. Sundmacher, T.L. Sheppard, ChemCatChem 14 (2022).
LibreCat | DOI
 

2021 | Book Chapter | LibreCat-ID: 24935 | OA
Laborpraktika auf Distanz. Ansätze in den Naturwissenschaften
A. Bauer, M. Sacher, S. Habig, S. Fechner, in: I. Neiske, J. Osthushenrich, N. Schaper, U. Trier, N. Vöing (Eds.), Hochschule auf Abstand. Ein multiperspektivischer Zugang zur digitalen Lehre, transcript Verlag, Bielefeld, 2021, pp. 155–168.
LibreCat | Download (ext.)
 

2021 | Journal Article | LibreCat-ID: 25182
Water or Anion? Uncovering the Zn2+ Solvation Environment in Mixed Zn(TFSI)2 and LiTFSI Water-in-Salt Electrolytes
Y. Zhang, G. Wan, N.H.C. Lewis, J. Mars, S.E. Bone, H.-G. Steinrück, M.R. Lukatskaya, N.J. Weadock, M. Bajdich, O. Borodin, A. Tokmakoff, M.F. Toney, E.J. Maginn, ACS Energy Letters 6 (2021) 3458–3463.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 25183
Quantification of Efficiency in Lithium Metal Negative Electrodes via Operando X-ray Diffraction
N.R. Geise, R.M. Kasse, J. Nelson Weker, H.-G. Steinrück, M.F. Toney, Chemistry of Materials 33 (2021) 7537–7545.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 25184
Toward Unraveling the Origin of Lithium Fluoride in the Solid Electrolyte Interphase
C. Cao, T.P. Pollard, O. Borodin, J.E. Mars, Y. Tsao, M.R. Lukatskaya, R.M. Kasse, M.A. Schroeder, K. Xu, M.F. Toney, H.-G. Steinrück, Chemistry of Materials 33 (2021) 7315–7336.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 25272
Zinc Anodizing: Structural Diversity of Anodic Zinc Oxide Controlled by the Type of Electrolyte
K. Engelkemeier, A. Sun, D. Voswinkel, O. Grydin, M. Schaper, W. Bremser, ChemElectroChem (2021) 2155–2168.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 28198 LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 26011
Self-Assembled Fibrinogen Hydro- and Aerogels with Fibrin-like 3D Structures
D. Hense, A. Büngeler, F. Kollmann, M. Hanke, A. Orive, A. Keller, G. Grundmeier, K. Huber, O.I. Strube, Biomacromolecules 22 (2021) 4084–4094.
LibreCat | DOI
 

2021 | Conference Paper | LibreCat-ID: 26718 | OA
Erweiterung des epistemologischen Verständnisses durch Konfrontation mit anomalen Daten.
P. Pollmeier, S. Fechner, in: S. Habig (Ed.), Naturwissenschaftlicher Unterricht und Lehrerbildung im Umbruch?, Universität Duisburg-Essen, 2021, pp. 605–608.
LibreCat | Download (ext.)
 

2021 | Journal Article | LibreCat-ID: 26759
Morphological Dynamics of Leukemia Cells on TiO2 Nanoparticle Coatings Studied by AFM
J.A. Garcia Diosa, A. Gonzalez Orive, G. Grundmeier, R.J. Camargo Amado, A. Keller, Applied Sciences 11 (2021) 9898.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 26985
Influence of thickness, homogeneity, and morphology of TiO2-m nanoparticle coatings on cancer cell adhesion
J.A. Garcia-Diosa, A.G. Orive, G. Grundmeier, A. Keller, R.J. Camargo-Amado, Surface and Coatings Technology (2021) 127823.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 27016
Using In Situ High-Energy X-ray Diffraction to Quantify Electrode Behavior of Li-Ion Batteries from Extreme Fast Charging
P.P. Paul, C. Cao, V. Thampy, H.-G. Steinrück, T.R. Tanim, A.R. Dunlop, S.E. Trask, A.N. Jansen, E.J. Dufek, J. Nelson Weker, M.F. Toney, ACS Applied Energy Materials 4 (2021) 11590–11598.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 27017
Unraveling the Unconventional Order of a High-Mobility Indacenodithiophene–Benzothiadiazole Copolymer
C. Cendra, L. Balhorn, W. Zhang, K. O’Hara, K. Bruening, C.J. Tassone, H.-G. Steinrück, M. Liang, M.F. Toney, I. McCulloch, M.L. Chabinyc, A. Salleo, C.J. Takacs, ACS Macro Letters 10 (2021) 1306–1314.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 21207
Guanine condensates as covalent materials and the concept of cryptopores
J. Kossmann, D. Piankova, N. V. Tarakina, J.J. Heske, T. Kühne, J. Schmidt, M. Antonietti, N. López-Salas, Carbon 172 (2021) 497–505.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 23609
Visualization of dynamic polaronic strain fields in hybrid lead halide perovskites
B. Guzelturk, T. Winkler, T.W.J. Van de Goor, M.D. Smith, S.A. Bourelle, S. Feldmann, M. Trigo, S.W. Teitelbaum, H.-G. Steinrück, G.A. de la Pena, R. Alonso-Mori, D. Zhu, T. Sato, H.I. Karunadasa, M.F. Toney, F. Deschler, A.M. Lindenberg, Nature Materials 20 (2021) 618–623.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 23610
A Review of Existing and Emerging Methods for Lithium Detection and Characterization in Li‐Ion and Li‐Metal Batteries
P.P. Paul, E.J. McShane, A.M. Colclasure, N. Balsara, D.E. Brown, C. Cao, B. Chen, P.R. Chinnam, Y. Cui, E.J. Dufek, D.P. Finegan, S. Gillard, W. Huang, Z.M. Konz, R. Kostecki, F. Liu, S. Lubner, R. Prasher, M.B. Preefer, J. Qian, M.F. Rodrigues, M. Schnabel, S. Son, V. Srinivasan, H.-G. Steinrück, T.R. Tanim, M.F. Toney, W. Tong, F. Usseglio‐Viretta, J. Wan, M. Yusuf, B.D. McCloskey, J. Nelson Weker, Advanced Energy Materials 11 (2021) 2100372.
LibreCat | DOI
 
 

2021 | Journal Article | LibreCat-ID: 23612
Water-in-Salt LiTFSI Aqueous Electrolytes. 1. Liquid Structure from Combined Molecular Dynamics Simulation and Experimental Studies
Y. Zhang, N.H.C. Lewis, J. Mars, G. Wan, N.J. Weadock, C.J. Takacs, M.R. Lukatskaya, H.-G. Steinrück, M.F. Toney, A. Tokmakoff, E.J. Maginn, The Journal of Physical Chemistry B 125 (2021) 4501–4513.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 23613
Oligothiophene Phosphonic Acids for Self-Assembled Monolayer Field-Effect Transistors
B. Zhao, B. Gothe, A. Groh, T. Schmaltz, J. Will, H.-G. Steinrück, T. Unruh, S. Mecking, M. Halik, ACS Applied Materials & Interfaces 13 (2021) 32461–32466.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 23614
Lamellar carbon-aluminosilicate nanocomposites with macroscopic orientation
D. Paripović, L. Hartmann, H.-G. Steinrück, A. Magerl, G. Li-Destri, Y. Fontana, A. Fontcuberta i Morral, E. Oveisi, E. Bomal, H. Frauenrath, Nanoscale 13 (2021) 13650–13657.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 23615
Quantification of heterogeneous, irreversible lithium plating in extreme fast charging of lithium-ion batteries
P.P. Paul, V. Thampy, C. Cao, H.-G. Steinrück, T.R. Tanim, A.R. Dunlop, E.J. Dufek, S.E. Trask, A.N. Jansen, M.F. Toney, J. Nelson Weker, Energy & Environmental Science 14 (2021) 4979–4988.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 23616
Orientation-Dependent Distortion of Lamellae in a Block Copolymer Electrolyte under DC Polarization
M.D. Galluzzo, L.S. Grundy, C.J. Takacs, C. Cao, H.-G. Steinrück, S. Fu, M.A. Rivas Valadez, M.F. Toney, N.P. Balsara, Macromolecules 54 (2021) 7808–7824.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 22636
Nanoscale Surface Topography Modulates hIAPP Aggregation Pathways at Solid–Liquid Interfaces
M. Hanke, Y. Yang, Y. Ji, G. Grundmeier, A. Keller, International Journal of Molecular Sciences 22 (2021) 5142.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 22637
Unraveling the interaction between doxorubicin and DNA origami nanostructures for customizable chemotherapeutic drug release
H. Ijäs, B. Shen, A. Heuer-Jungemann, A. Keller, M.A. Kostiainen, T. Liedl, J.A. Ihalainen, V. Linko, Nucleic Acids Research 49 (2021) 3048–3062.
LibreCat | DOI
 

Filters and Search Terms

department=2

Search

Filter Publications

Display / Sort

Export / Embed