News & Latest Publications

Latest Publications


“Gecko adhesion: A molecular-simulation perspective on the effect of humidity”, T. Materzok, S. Gorb, and F. Müller-Plathe, Soft Matter 18, 1247–1263 (2022). [DOI: 10.1039/d1sm01232k]

“Self-Assembly of Model Triblock Janus Colloidal Particles in Two Dimensions”, K. Bahri, H. Eslami, and Florian Müller-Plathe, J. Chem. Theor. Comput. 18, 1870–1882 (2022). [DOI: 10.1021/acs.jctc.1c01116]

“Addressing surface effects at the particle-continuum interface in a molecular dynamics and finite elements coupled multiscale simulation technique”, Y. Jain, M. Ries, S. Pfaller, and F. Müller-Plathe, J. Chem. Theor. Comput. 18, 2375–2387 (2022). [DOI: 10.1021/acs.jctc.1c00940]

“How Ethanolic Disinfectants Disintegrate Coronavirus Model Membranes: A Dissipative-Particle-Dynamics Simulation Study”, T. Zhou, Z. Wu, S. Das, H. Eslami, and F. Müller-Plathe, J. Chem. Theor. Comput. 18, 2597–2615 (2022). [DOI: 10.1021/acs.jctc.1c01120]

“Effect of polymer on a contact line friction of a capillary bridge”, E. Lee and F. Müller-Plathe, Macromolecules 55, 2649–2658 (2022). [DOI: 10.1021/acs.macromol.1c02539]

“Roughness volumes: An improved RoughMob concept for predicting the increase of molecular mobility upon coarse-graining”, M.K. Meinel and F. Müller-Plathe, J. Phys. Chem. B 126, 3737−3747 (2022). [DOI: 10.1021/acs.jpcb.2c00944]

“Slip-Spring Hybrid Particle-Field Model for Coarse-Graining Branched Polymer Melts: Polystyrene Melts as an Example”, Z. Wu and F. Müller-Plathe, J. Chem. Theor. Comput. 18, 3814–3828 (2022). [DOI: 10.1021/acs.jctc.2c00107]

“Boron-Modified Perhydropolysilazane Towards Facile and Economical Synthesis of Amorphous SiBN Ceramic with Excellent Thermal Stability”, Y. Zhan, W. Li, T. Jiang, C. Fasel, E. Ricohermoso III, J. Bernauer, Z. Yu, Z. Wu, F. Müller-Plathe, L. Molina-Luna, R. Grottenmüller, and R. Riedel, J. Adv. Ceram. 11, 1104–1116 (2022). [DOI: 10.1007/s40145-022-0597-z]

“Conductance switching in liquid crystal-inspired self-assembled monolayer junctions”, J. M. Dlugosch, H. Seim, A. Bora, T. Kamiyama, I. Lieberman, F. May, F. Müller-Plathe, A. Nefedov, S. Prasad, S. Resch, K. Saller, C. Seim, M. Speckbacher, F. Voges, M. Tornow, and P. Kirsch, ACS Appl. Mater. Interfaces 14, 31044–31053 (2022). [DOI: 10.1021/acsami.2c05264]

“Mobility of polymer melts in a regular array of carbon nanotubes”, S.A.N. Alberti, J. Schneider, and F. Müller-Plathe, J. Chem. Theor. Comput. 18, 3285–3295 (2022). [DOI: 10.1021/acs.jctc.1c01281]

“Contact line friction and dynamic contact angles of a capillary bridge between superhydrophobic nanostructured surfaces”, E. Lee and F. Müller-Plathe, J. Chem. Phys. 157, 024701 (2022). [DOI: 10.1063/5.0098150]

“Gecko adhesion on flat and rough surfaces: Simulations with a multi-scale molecular model”, T. Materzok, D. De Boer, S. Gorb, and F. Müller-Plathe, Small 18, 2201674 (2022). [DOI: 10.1002/smll.202201674]

“Computing the Work of Solid-Liquid Adhesion in Systems with Damped Coulomb Interactions via Molecular Dynamics: Approaches and Insights”, D. Surblys, F. Müller-Plathe, and T. Ohara, J. Phys. Chem. A 126, 5506–5516 (2022). [DOI: 10.1021/acs.jpca.2c03934]

“Compatibilization Efficiency of Graft Copolymers in Incompatible Polymer Blends: Dissipative Particle Dynamics Simulations Combined with Machine Learning”, T. Zhou, D. Qiu, Z. Wu, S.A.N. Alberti, S. Bag, J. Schneider, J. Meyer, J. Gámez, M. Gieler, M. Reithmeier, A. Seidel, and F. Müller-Plathe, Macromolecules 55, 7893−7907 (2022). [DOI: 10.1021/acs.macromol.2c00821]

“Water Uptake by Gecko b-Keratin and the Influence of the Relative Humidity on its Mechanical and Volumetric Properties”, M. Khani, T. Materzok, H. Eslami, S. Gorb, and F. Müller-Plathe, J. R. Soc. Interface 19, 20220372 (2022). [DOI: 10.1098/rsif.2022.0372]

“How does gecko keratin stick to hydrophilic and hydrophobic surfaces in the presence and absence of water? An atomistic molecular-dynamics investigation”, T. Materzok, A. Canestraight, S. Gorb, and F. Müller-Plathe, ACS Nano 16, 19261–19270 (2022). [DOI: 10.1021/acsnano.2c08627]

“Toward a mobility preserving coarse-grained model: A data driven approach”, S. Bag, M.K. Meinel, and F. Müller-Plathe, J. Chem. Theor. Comput. 18, 7108–7120 (2022). [DOI: 10.1021/acs.jctc.2c00898]

“Stopping Droplet Rebound with Polymer Additives: A Molecular Viewpoint”, E. Lee, H. K. Chilukoti, and F. Müller-Plathe, in: K. Schulte, C. Tropea, and B. Weigand (Eds.), Droplet Dynamics under Extreme Ambient Conditions, Fluid Mechanics and its Application 124, (Springer, Heidelberg, 2022) pp 87–106. ISBN 978-3-031-09007-3 [DOI: 10.1007/978-3-031-09008-0_5]

To see the complete publication lists please follow the links below

Prof. Dr. Florian Müller-Plathe

Group members without co-authorship of Florian Mülller-Plathe