Publications

• A. Gubbiotti, M. Baldelli, G. Di Muccio, P. Malgaretti, S. Marbach and M. Chinappi, Electroosmosis in nanopores: computational methods and technological applications. Advances in Physics: X 2022, 7 (1), 2036638 (Project D02).
• A. Baer, P. Malgaretti, M. Kaspereit, J. Harting and A.-S. Smith, Modelling diffusive transport of particles interacting with slit nanopore walls: The case of fullerenes in toluene filled alumina pores. Journal of Molecular Liquids 2022, 368, 120636 (Project B05, D01, D02).
• M. Kuchlbauer, F. Liers and M. Stingl, Outer Approximation for Mixed-Integer Nonlinear Robust Optimization. Journal of Optimization Theory and Applications 2022, 195 (3), 1056-1086 (Project D05, D06).
• Z. Zhang, A. Sukhov, J. Harting, P. Malgaretti and D. Ahmed, Rolling microswarms along acoustic virtual walls. Nat. Commun. 2022, 13 (1), 7347 (Project D02).
• M. Schöttle, T. Lauster, L. J. Roemling, N. Vogel and M. Retsch, A Continuous Gradient Colloidal Glass. Advanced Materials 2022, 2208745 (Project A05).
• G. M. Coclite, J.-M. Coron, N. De Nitti, A. Keimer and L. Pflug, A general result on the approximation of local conservation laws by nonlocal conservation laws: The singular limit problem for exponential kernels. Ann. Inst. H. Poincaré Anal. Non Linéaire 2022,  (Project D03).
• G. M. Coclite, N. De Nitti, A. Keimer and L. Pflug, On existence and uniqueness of weak solutions to nonlocal conservation laws with BV kernels. Zeitschrift für angewandte Mathematik und Physik 2022, 73 (6), 241 (Project D03).
• G. C. Antunes, P. Malgaretti, J. Harting and S. Dietrich, Pumping and Mixing in Active Pores. Physical Review Letters 2022, 129 (18), 188003 (Project D02).
• M. Supper, K. Heller, J. Söllner, T. Sainio and M. Kaspereit, Separation of Molar Weight-Distributed Polyethylene Glycols by Reversed-Phase Chromatography—Analysis and Modeling Based on Isocratic Analytical-Scale Investigations. Processes 2022, 10 (11), 2160 (Project B05).
• S. L. A. Bueno, A. Leonardi, N. Kar, K. Chatterjee, X. Zhan, C. Chen, Z. Wang, M. Engel, V. Fung and S. E. Skrabalak, Quinary, Senary, and Septenary High Entropy Alloy Nanoparticle Catalysts from Core@Shell Nanoparticles and the Significance of Intraparticle Heterogeneity. ACS Nano 2022,  (Project D04).
• S. Wenderoth, G. Bleyer, J. Endres, J. Prieschl, N. Vogel, S. Wintzheimer and K. Mandel, Spray-Dried Photonic Balls with a Disordered/Ordered Hybrid Structure for Shear-Stress Indication. Small 2022, 18 (48), 2203068 (Project A05).
• A. Uihlein, L. Pflug and M. Stingl, Optimizing Color of Particulate Products. Proceedings in Applied Mathematics and Mechanics 2022,  (Project D05).
• W. Wu, M. Supper, M. H. Rausch, M. Kaspereit and A. P. Fröba, Mutual Diffusivities of Binary Mixtures of Water and Poly(ethylene) Glycol from Heterodyne Dynamic Light Scattering. International Journal of Thermophysics 2022, 43 (12), 177 (Project B05, C03).
• O. Aouane, M. Sega, B. Bäuerlein, K. Avila and J. Harting, Inertial focusing of a dilute suspension in pipe flow. Physics of Fluids 2022, in press (Project D02).
• T. Schikarski, M. Avila, H. Trzenschiok, A. Güldenpfennig and W. Peukert, Quantitative modeling of precipitation processes. Chemical Engineering Journal 2022, 444, 136195 (Project A01).
• H. Zhou, R. Pujales-Paradela, P. Groppe, S. Wintzheimer and K. Mandel, Tuning the Morphology of Spray-Dried Supraparticles: Effects of Building Block Size and Concentration. Particle & Particle Systems Characterization 2022, 2200127 (Project KM).
• P. Cardenas Lopez, M. J. Uttinger, N. E. Traoré, H. A. Khan, D. Drobek, B. Apeleo Zubiri, E. Spiecker, L. Pflug, W. Peukert and J. Walter, Multidimensional characterization of noble metal alloy nanoparticles by multiwavelength analytical ultracentrifugation. Nanoscale 2022, 14 (35), 12928-12939 (Project A01, C01, C04, D03).
• N. Nees, L. Pflug, B. Mann and M. Stingl, Multi-material design optimization of optical properties of particulate products by discrete dipole approximation and sequential global programming. Structural and Multidisciplinary Optimization 2022,  (Project D05).
• A. Bayen, J. Friedrich, A. Keimer, L. Pflug and T. Veeravalli, Modeling Multilane Traffic with Moving Obstacles by Nonlocal Balance Laws. SIAM Journal on Applied Dynamical Systems 2022, 21 (2), 1495-1538 (Project D03).
• S. Ziegler and A.-S. Smith, Hydrodynamic particle interactions in linear and radial viscosity gradients. Journal of Fluid Mechanics 2022, 943, A29 (Project D01).
• M. Distaso, V. Lautenbach, M. J. Uttinger, J. Walter, C. Lübbert, T. Thajudeen and W. Peukert, A widely applicable method to stabilize nanoparticles comprising oxygen-rich functional groups. Powder Technology 2022, 117633 (Project A01, C04).
• S. Glante, D. Wisser, M. Hartmann, M. Joos, R. E. Dinnebier and S. Bette, Lattice Modification and Morphological Control of Halide-Substituted yqt-Type Zeolitic Imidazolate Frameworks Zn3mim5X, with X = F, Br, Cl, or OH. Crystal Growth & Design 2022, 22 (6), 3795-3807 (Project A04, C02).
• M. Rey, J. Walter, J. Harrer, C. M. Perez, S. Chiera, S. Nair, M. Ickler, A. Fuchs, M. Michaud, M. J. Uttinger, A. B. Schofield, J. H. J. Thijssen, M. Distaso, W. Peukert and N. Vogel, Versatile strategy for homogeneous drying patterns of dispersed particles. Nat. Commun. 2022, 13 (1), 2840 (Project A05, C04).
• A. Völkl and R. N. Klupp Taylor, Investigation and mitigation of reagent ageing during the continuous flow synthesis of patchy particles. Chemical Engineering Research and Design 2022, 181, 133-143 (Project A03).
• M. Cvitković, D. Ghanti, N. Raake and A.-S. Smith, Crowding competes with trapping to enhance interfacial diffusion. The European Physical Journal Plus 2022, 137 (3), 355 (Project D01).
• D. Jung, M. J. Uttinger, P. Malgaretti, W. Peukert, J. Walter and J. Harting, Hydrodynamic simulations of sedimenting dilute particle suspensions under repulsive DLVO interactions. Soft Matter 2022, 18 (11), 2157-2167 (Project C04, D02).
• J. Wang, Y. Liu, G. Bleyer, E. S. A. Goerlitzer, S. Englisch, T. Przybilla, C. F. Mbah, M. Engel, E. Spiecker, I. Imaz, D. Maspoch and N. Vogel, Coloration in Supraparticles Assembled from Polyhedral Metal-Organic Framework Particles. Angewandte Chemie International Edition 2022, 61 (16), e202117455 (Project A05, C01, D04).
• J. Wang, S. Hahn, E. Amstad and N. Vogel, Tailored Double Emulsions Made Simple. Advanced Materials 2022, 34 (5), 2107338 (Project A05).
• N. Roy, R. Dürr, A. Bück, J. Kumar and S. Sundar, Numerical methods for particle agglomeration and breakage in lid-driven cavity flows at low Reynolds numbers. Mathematics and Computers in Simulation 2022, 192, 33-49 (Project B02).
• T. Meincke, J. Walter, L. Pflug, T. Thajudeen, A. Völkl, P. Cardenas Lopez, M. J. Uttinger, M. Stingl, S. Watanabe, W. Peukert and R. N. Klupp Taylor, Determination of the yield, mass and structure of silver patches on colloidal silica using multiwavelength analytical ultracentrifugation. Journal of Colloid and Interface Science 2022, 607, 698-710 (Project A03, C04, D05).
• T. Schikarski, M. Avila and W. Peukert, En route towards a comprehensive dimensionless representation of precipitation processes. Chemical Engineering Journal 2022, 428, 131984 (Project A01).
• U. Frank, M. J. Uttinger, S. E. Wawra, C. Lübbert and W. Peukert, Progress in Multidimensional Particle Characterization. KONA Powder and Particle Journal 2022, advpub,  (Project C04).
• C. Schlumberger, C. Scherdel, M. Kriesten, P. Leicht, A. Keilbach, H. Ehmann, P. Kotnik, G. Reichenauer and M. Thommes, Reliable surface area determination of powders and meso/macroporous materials: Small-angle X-ray scattering and gas physisorption. Microporous and Mesoporous Materials 2022, 329, 111554 (Project B03).
• W. Peukert, M. Kaspereit, T. Hofe and L. Gromotka, Size Exclusion Chromatography (SEC). In Particle Separation Techniques: Fundamentals, Instrumentation, and Selected Applications, Contado, C., Ed. Elsevier: 2022, (Project B04, B05).
• J. Dienstbier, K.-M. Aigner, J. Rolfes, W. Peukert, D. Segets, L. Pflug and F. Liers, Robust optimization in nanoparticle technology: A proof of principle by quantum dot growth in a residence time reactor. Computers & Chemical Engineering 2022, 157, 107618 (Project A01, A02, D03, D06).
• C. Damm and W. Peukert, Chapter 3 – Particle dispersions in liquid media. In Particle Separation Techniques, Contado, C., Ed. Elsevier: 2022; pp 27-62, (ProjectB04).

2021

• J. Wang, E. Kang, U. Sultan, B. Merle, A. Inayat, B. Graczykowski, G. Fytas and N. Vogel, Influence of Surfactant-Mediated Interparticle Contacts on the Mechanical Stability of Supraparticles. The Journal of Physical Chemistry C 2021, 125 (42), 23445-23456 (Project B01).
• J. Wang, J. Schwenger, A. Ströbel, P. Feldner, P. Herre, S. Romeis, W. Peukert, B. Merle and N. Vogel, Mechanics of colloidal supraparticles under compression. Science Advances 2021, 7 (42), eabj0954 (Project B01, B04).
• Y. Liu, M. Klement, Y. Wang, Y. Zhong, B. Zhu, J. Chen, M. Engel and X. Ye, Macromolecular Ligand Engineering for Programmable Nanoprism Assembly. Journal of the American Chemical Society 2021, 143(39), 16163-16172 (Project D04).
• G. M. Coclite, N. De Nitti, A. Keimer and L. Pflug, Singular limits with vanishing viscosity for nonlocal conservation laws. Nonlinear Analysis 2021, 211, 112370 (Project D03).
• C. Lübbert and W. Peukert, Characterization of Electrospray Drop Size Distributions by Mobility-Classified Mass Spectrometry: Implications for Ion Clustering in Solution and Ion Formation Pathways. Anal. Chem. 2021, 93 (38), 12862-12871 (Project C04).
• M. Hartmann and Y. S. Avadhut, Solid State Magnetic Resonance Spectroscopy of Metal Oxide Nanoparticles. In Metal Oxide Nanoparticles, 2021; pp 513-555, (Project A04, C02).
• O. Diwald and M. Hartmann, Adsorption and Chemical Reactivity. In Metal Oxide Nanoparticles, 2021; pp 593-636, (Project A04, C02).
• E. S. Asmolov, T. V. Nizkaya, J. Harting and O. I. Vinogradova, Instability of particle inertial migration in shear flow. Physics of Fluids 2021, 33 (9), 092008 (Project D02).
• M. Sarcletti, H. Park, J. Wirth, S. Englisch, A. Eigen, D. Drobek, D. Vivod, B. Friedrich, R. Tietze, C. Alexiou, D. Zahn, B. Apeleo Zubiri, E. Spiecker and M. Halik, The remediation of nano-/microplastics from water. Materials Today 2021, 48, 38-46 (Project C01).
• A. Bayen, J.-M. Coron, N. De Nitti, A. Keimer and L. Pflug, Boundary Controllability and Asymptotic Stabilization of a Nonlocal Traffic Flow Model. Vietnam Journal of Mathematics 2021, 49 (3), 957-985 (Project D03).
• M. Klement, S. Lee, J. A. Anderson and M. Engel, Newtonian Event-Chain Monte Carlo and Collision Prediction with Polyhedral Particles. Journal of Chemical Theory and Computation 2021, 17 (8), 4686-4696 (Project D04).
• Y. Sun, R. F. DeJaco, Z. Li, D. Tang, S. Glante, D. S. Sholl, C. M. Colina, R. Q. Snurr, M. Thommes, M. Hartmann and J. I. Siepmann, Fingerprinting diverse nanoporous materials for optimal hydrogen storage conditions using meta-learning. Science Advances 2021, 7 (30), eabg3983 (Project C02).
• J. Wirth, S. Englisch, D. Drobek, B. Apeleo Zubiri, M. Wu, N. Taccardi, N. Raman, P. Wasserscheid and E. Spiecker, Unraveling Structural Details in Ga-Pd SCALMS Systems Using Correlative Nano-CT, 360° Electron Tomography and Analytical TEM. Catalysts 2021, 11 (7), 810 (Project C01).
• P. Malgaretti and J. Harting, Phoretic colloids close to and trapped at fluid interfaces. ChemNanoMat 2021, 7(10), 1073-1081 (Project D02).
• A. Hegetschweiler, A.-R. Jochem, A. Zimmermann, J. Walter, T. Staudt and T. Kraus, Colloidal Analysis of Particles Extracted from Microalloyed Steels. Particle & Particle Systems Characterization 2021, 38 (7), 2000236 (Project C04).
• M. Thommes and C. Schlumberger, Characterization of Nanoporous Materials. Annual Review of Chemical and Biomolecular Engineering 2021, 12 (1), 137-162 (Project B03, C02).
• M. Hubert, O. Trosman, Y. Collard, A. Sukhov, J. Harting, N. Vandewalle and A. S. Smith, Scallop Theorem and Swimming at the Mesoscale. Physical Review Letters 2021, 126 (22), 224501 (Project D01, D02).
• H. Canziani, F. Bever, A. Sommereyns, M. Schmidt and N. Vogel, Roughly Spherical: Tailored PMMA–SiO2 Composite Supraparticles with Optimized Powder Flowability for Additive Manufacturing. ACS Applied Materials & Interfaces 2021, 13 (21), 25334-25345 (Project B01).
• M. F. Carusela, P. Malgaretti and J. M. Rubi, Antiresonant driven systems for particle manipulation. Physical Review E 2021, 103 (6), 062102 (Project D02).
• H. S. H. Nguyen, M. Kaspereit and T. Sainio, Intermittent recycle-integrated reactor-separator for production of well-defined non-digestible oligosaccharides from oat β-glucan. Chemical Engineering Journal 2021, 410, 128352 (Project B05).
• J.-P. Grass, K. Klühspies, B. Reiprich, W. Schwieger and A. Inayat, Layer-Like Zeolite X as Catalyst in a Knoevenagel Condensation: The Effect of Different Preparation Pathways and Cation Exchange. Catalysts2021, 11 (4), 474 (Project B01).
• J. Saha and A. Bück, Conservative Finite Volume Schemes for Multidimensional Fragmentation Problems. Mathematics 2021, 9 (6), 635 (Project B02).
• J. Semmler and M. Stingl, On the efficient optimization of optical properties of particulate monolayers by a hybrid finite element approach. Structural and Multidisciplinary Optimization 2021, 63 (3), 1219-1242 (Project D05).
• C. Schlumberger and M. Thommes, Characterization of Hierarchically Ordered Porous Materials by Physisorption and Mercury Porosimetry—A Tutorial Review. Advanced Materials Interfaces 2021, 8 (4), 2002181 (Project B03, C02).
• M. J. Uttinger, D. Jung, N. Dao, H. Canziani, C. Lübbert, N. Vogel, W. Peukert, J. Harting and J. Walter, Probing sedimentation non-ideality of particulate systems using analytical centrifugation. Soft Matter 2021, 17 (10), 2803-2814 (Project A05, C04, D02).
• B. Apeleo Zubiri, J. Wirth, D. Drobek, S. Englisch, T. Przybilla, T. Weissenberger, W. Schwieger and E. Spiecker, Correlative Laboratory Nano-CT and 360° Electron Tomography of Macropore Structures in Hierarchical Zeolites. Advanced Materials Interfaces 2021, 8 (4), 2001154 (Project C01).
• T. Sainio and M. Kaspereit, Analysis of reactor–separator processes for polymeric and oligomeric degradation products with controlled molar mass distributions. Chemical Engineering Science 2021, 229, 116154 (Project B05).
• P. Malgaretti and J. Harting, Transport of neutral and charged nanorods across varying-section channels. Soft Matter 2021, 17 (8), 2062-2070 (Project D02).

• F. J. Wendisch, M. Rey, N. Vogel and G. R. Bourret, Large-Scale Synthesis of Highly Uniform Silicon Nanowire Arrays Using Metal-Assisted Chemical Etching. Chemistry of Materials 2020, 32 (21), 9425-9434 (Project A05).
• J.-M. Coron, A. Keimer and L. Pflug, Nonlocal Transport Equations—Existence and Uniqueness of Solutions and Relation to the Corresponding Conservation Laws. SIAM Journal on Mathematical Analysis 2020, 52(6), 5500-5532 (Project D03).
• N. Kulyk, D. Berger, A.-S. Smith and J. Harting, Catalytic flow with a coupled finite difference — Lattice Boltzmann scheme. Computer Physics Communications 2020, 256, 107443 (Project D01, D02).
• D. V. Talapin, M. Engel and P. V. Braun, Functional materials and devices by self-assembly. MRS Bulletin 2020, 45 (10), 799-806 (Project D04).
• H. Canziani, S. Chiera, T. Schuffenhauer, S.-P. Kopp, F. Metzger, A. Bück, M. Schmidt and N. Vogel, Bottom-Up Design of Composite Supraparticles for Powder-Based Additive Manufacturing. Small 2020, 16 (30), 2002076 (Project B01, B02).
• M. J. Uttinger, S. Boldt, S. E. Wawra, T. D. Freiwald, C. Damm, J. Walter, D. Lerche and W. Peukert, New Prospects for Particle Characterization Using Analytical Centrifugation with Sector-Shaped Centerpieces. Particle & Particle Systems Characterization 2020, 37 (7), 2000108 (Project C04).
• L. Pflug, N. Bernhardt, M. Grieshammer and M. Stingl, CSG: A new stochastic gradient method for the efficient solution of structural optimization problems with infinitely many states. Structural and Multidisciplinary Optimization 2020, 61 (6), 2595-2611 (Project D05).
• L. Pflug, T. Schikarski, A. Keimer, W. Peukert and M. Stingl, eMoM: Exact method of moments—Nucleation and size dependent growth of nanoparticles. Computers & Chemical Engineering 2020, 136, 106775 (Project A01, D03).
• R. Stepić, L. Jurković, K. Klementyeva, M. Ukrainczyk, M. Gredičak, D. M. Smith, D. Kralj and A.-S. Smith, Adsorption of Aspartate Derivatives to Calcite Surfaces in Aqueous Environment. Crystal Growth & Design 2020, 20 (5), 2853-2859 (Project D01).
• J. Dienstbier, J. Schmölder, R. Burlacu, F. Liers and M. Kaspereit, Global optimization of batch and steady-state recycling chromatography based on the equilibrium model. Computers & Chemical Engineering 2020, 135, 106687 (Project B05, D06).
• S. Süβ, K. Bartsch, C. Wasmus, C. Damm, D. Segets and W. Peukert, Chromatographic property classification of narrowly distributed ZnS quantum dots. Nanoscale 2020, 12 (22), 12114-12125 (Project A02, B04).
• M. Spinola, A. Keimer, D. Segets, G. Leugering and L. Pflug, Model-Based Optimization of Ripening Processes with Feedback Modules. Chemical Engineering & Technology 2020, 43 (5), 896-903 (Project A02, D03).
• F. E. Berger Bioucas, M. H. Rausch, J. Schmidt, A. Bück, T. M. Koller and A. P. Fröba, Effective Thermal Conductivity of Nanofluids: Measurement and Prediction. International Journal of Thermophysics 2020, 41(5), 55 (Project B02, C03).
• M. Rey, M. J. Uttinger, W. Peukert, J. Walter and N. Vogel, Probing particle heteroaggregation using analytical centrifugation. Soft Matter 2020, 16 (14), 3407-3415 (Project A05, C04).
• J. T. L. Gamler, A. Leonardi, X. Sang, K. M. Koczkur, R. R. Unocic, M. Engel and S. E. Skrabalak, Effect of lattice mismatch and shell thickness on strain in core@shell nanocrystals. Nanoscale Advances 2020, 2 (3), 1105-1114 (Project D04).
• J. Schmölder and M. Kaspereit, A Modular Framework for the Modelling and Optimization of Advanced Chromatographic Processes. Processes 2020, 8 (1), 65 (Project B05).
• C. Giraudet, M. S. G. Knoll, Y. Galvan, S. Süß, D. Segets, N. Vogel, M. H. Rausch and A. P. Fröba, Diffusion of Gold Nanoparticles in Inverse Opals Probed by Heterodyne Dynamic Light Scattering. Transport in Porous Media 2020, 131 (2), 723-737 (Project A02, B01, C03).