Publications

Alexander Reinauer, Svyatoslav Kondrat, und Christian Holm. Electrolytes in conducting nanopores: Revisiting constant charge and constant potential simulations. The Journal of chemical physics, (161)10:104101--, United States, September 2024. [PUMA: EXC2075 PN3 PN3-3 curated] URL

Simon Gravelle, David Beyer, Mariano Brito, Alexander Schlaich, und Christian Holm. Assessing the Validity of NMR Relaxation Rates Obtained from Coarse-Grained Simulations of PEG–Water Mixtures. The Journal of Physical Chemistry B, (127)25:5601--5608, American Chemical Society (ACS), Juni 2023. [PUMA: EXC2075 PN1 PN3 PN3-15 PN3-3 curated] URL

Fabian Zills, Moritz René Schäfer, Samuel Tovey, Johannes Kästner, und Christian Holm. Machine Learning-Driven Investigation of the Structure and Dynamics of the BMIM-BF₄ Room Temperature Ionic Liquid. Faraday Discuss., The Royal Society of Chemistry, 2024. [PUMA: EXC2075 PN3 PN3-3 curated] URL

Christoph Lohrmann, Christian Holm, und Sujit S. Datta. Influence of bacterial swimming and hydrodynamics on infection by phages. bioRxiv, Cold Spring Harbor Laboratory, Januar 2024. [PUMA: EXC2075 PN3 PN3-3 curated] URL

Rudolf Weeber, Jean-Noël Grad, David Beyer, Pablo M. Blanco, Patrick Kreissl, Alexander Reinauer, Ingo Tischler, Peter Košovan, und Christian Holm. ESPResSo, a Versatile Open-Source Software Package for Simulating Soft Matter Systems. Reference Module in Chemistry, Molecular Sciences and Chemical Engineering, Elsevier, 2023. [PUMA: EXC2075 PN3 PN3-12 PN3-3 curated] URL

Ingo Tischler, Alexander Schlaich, und Christian Holm. Disentanglement of Surface and Confinement Effects for Diene Metathesis in Mesoporous Confinement. ACS Omega, (9)1:598–606, American Chemical Society (ACS), Dezember 2023. [PUMA: EXC2075 PN3 PN3-3 PN3A-9 curated] URL

Henrik Jäger, Alexander Schlaich, Jie Yang, Cheng Lian, Svyatoslav Kondrat, und Christian Holm. A screening of results on the decay length in concentrated electrolytes. Faraday Discuss., (246)0:520-539, The Royal Society of Chemistry, August 2023. [PUMA: EXC2075 PN3 PN3-3 curated] URL

Jie Yang, Svyatoslav Kondrat, Cheng Lian, Honglai Liu, Alexander Schlaich, und Christian Holm. Solvent Effects on Structure and Screening in Confined Electrolytes. Phys. Rev. Lett., (131)11:118201, American Physical Society, September 2023. [PUMA: EXC2075 PN3 PN3-3 curated] URL

Simon Gravelle, Sabina Haber-Pohlmeier, Carlos Mattea, Siegfried Stapf, Christian Holm, und Alexander Schlaich. NMR Investigation of Water in Salt Crusts: Insights from Experiments and Molecular Simulations. Langmuir, (39)22:7548--7556, American Chemical Society, Mai 2023. [PUMA: EXC2075 PN3 PN3-3 curated] URL

Christoph Lohrmann, und Christian Holm. A novel model for biofilm initiation in porous media flow. Soft Matter, (19)36:6920-6928, The Royal Society of Chemistry, 2023. [PUMA: EXC2075 PN3 PN3-3 curated] URL

Christoph Lohrmann, und Christian Holm. Optimal motility strategies for self-propelled agents to explore porous media. Phys. Rev. E, (108)5:054401, American Physical Society, November 2023. [PUMA: EXC2075 PN3 PN3-3 curated] URL

Ingo Tischler, Florian Weik, Robert Kaufmann, Michael Kuron, Rudolf Weeber, und Christian Holm. A thermalized electrokinetics model including stochastic reactions suitable for multiscale simulations of reaction-advection-diffusion systems. Journal of computational science, (63):101770, Elsevier, 2022. [PUMA: EXC2075 PN3 PN3-3 curated]

Arndt Wagner, Elissa Eggenweiler, Felix Weinhardt, Zubin Trivedi, David Krach, Christoph Lohrmann, Kartik Jain, Nikolaos Karadimitriou, Carina Bringedal, Paul Voland, Christian Holm, Holger Class, Holger Steeb, und Iryna Rybak. Permeability Estimation of Regular Porous Structures: A Benchmark for Comparison of Methods. Transport in Porous Media, (138)1:1--23, Springer, 2021. [PUMA: EXC2075 PN1 PN1-4 PN3 PN3-3 curated merged] URL

Samuel Tovey, Anand Narayanan Krishnamoorthy, Ganesh Sivaraman, Jicheng Guo, Chris Benmore, Andreas Heuer, und Christian Holm. DFT accurate interatomic potential for molten NaCl from machine learning. The Journal of Physical Chemistry C, (124)47:25760-25768, ACS Publications, 2020. [PUMA: EXC2075 PN3 PN3-3 curated merged] URL

Michael Kuron, Cameron Stewart, Joost de Graaf, und Christian Holm. An extensible lattice Boltzmann method for viscoelastic flows: complex and moving boundaries in Oldroyd-B fluids. 2021. [PUMA: EXC2075 PN3 PN3-3 curated]

Kai Szuttor, Florian Weik, Jean-Noël Grad, und Christian Holm. Modeling the current modulation of bundled DNA structures in nanopores. The Journal of Chemical Physics, (154)5:054901, 2021. [PUMA: EXC2075 PN3 PN3-3 curated] URL

Kai Szuttor, Patrick Kreissl, und Christian Holm. A numerical investigation of analyte size effects in nanopore sensing systems. The Journal of Chemical Physics, (155)13:134902, 2021. [PUMA: EXC2075 PN3 PN3-3 curated] URL

Johannes Zeman, Svyatoslav Kondrat, und Christian Holm. Ionic screening in bulk and under confinement. The Journal of Chemical Physics, (155)20:204501, 2021. [PUMA: EXC2075 PN3 PN3-3 curated] URL

Julia M. Riede, Christian Holm, Syn Schmitt, und Daniel F. B. Haeufle. The control effort to steer self-propelled microswimmers depends on their morphology: comparing symmetric spherical versus asymmetric L -shaped particles. Royal Society Open Science, (8)9The Royal Society, September 2021. [PUMA: EXC2075 PN3 PN3-3 curated] URL

Johannes Zeman, Christian Holm, und Jens Smiatek. The Effect of Small Organic Cosolutes on Water Structure and Dynamics. Journal of Chemical & Engineering Data, (65)3:1197--1210, American Chemical Society (ACS), August 2019. [PUMA: EXC2075 PN3 PN3-3 curated] URL