Publications

Fabian Zills, Moritz R. 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., (253):129-145, 2024. [PUMA: 3 6 A-3 PN chemie kaestner kästner stuttgart theochem theoretische]

Fabian Zills, Moritz René Schäfer, Nico Segreto, Johannes Kästner, Christian Holm, und Samuel Tovey. Collaboration on Machine-Learned Potentials with IPSuite: A Modular Framework for Learning-on-the-Fly. J. Phys. Chem. B, (128):3662-3676, 2024. [PUMA: 3 6 A-1 A-3 A-5 A-7 AISA PN chemie kaestner kästner stuttgart theochem theoretische] URL