Subproject C05 Joining simulation

Lyu, S., Steinhoff, T., Janthur, F.-L., Seffer, S., Hermsdorf, J., Klose, C., Overmeyer, L., Maier, H.-J., Merkert, N. (2026): Investigation of Oxygen‐Free Wetting Behavior of Aluminum on Copper via Molecular Dynamics Simulations and Experiments,  Advanced Engineering Materials
DOI: 10.1002/adem.202502831

Zhang, H., Lyu, S., Reder, M., Merkert, N., Nestler, B. (2026): A phase-field model: Contact angle hysteresis driven by multistable surface composition,  Journal of colloid and interface science 708, p. 139781
DOI: 10.1016/j.jcis.2025.139781

Dude, D. P., Zhu, Y., Dörrer, L., Luu, H.-T., Tonn, B., Schmidt, H., Merkert, N. (2025): Zn Tracer Diffusion in α-Cu64Zn36: Bridging Experiments and Simulations,  Metallurgical and Materials Transactions A
DOI: 10.1007/s11661-025-07991-2

Luu, H.-T., Merkert, N. (2025): Investigation of solid-state diffusion bonding of Al–Cu interfaces of metal joints using molecular dynamics simulations,  Results in Surfaces and Interfaces 20, p. 100574
DOI: 10.1016/j.rsurfi.2025.100574

Raumel, S., Barienti, K., Luu, H.-T., Merkert, N., Dencker, F., Nürnberger, F., Maier, H. J., Wurz, M. C. (2023): Characterization of the tribologically relevant cover layers formed on copper in oxygen and oxygen-free conditions,  Friction
DOI: 10.1007/s40544-022-0695-5

Homann, S., Luu, H.-T., Merkert, N. (2022): Molecular dynamics simulations of the machining of oxidized and deoxidized titanium work pieces,  Results in Surfaces and Interfaces 9, p. 100085
DOI: 10.1016/j.rsurfi.2022.100085

Luu, H.-T., Raumel, S., Dencker, F., Wurz, M., Merkert, N. (2022): Nanoindentation in alumina coated Al: Molecular dynamics simulations and experiments,  Surface and Coatings Technology 437, p. 128342
DOI: 10.1016/j.surfcoat.2022.128342

Plack, A., Bierwirth, M., Weber, A. P., Gunkelmann, N. (2022): Experimental and atomistic study of high speed collisions of gold nanoparticles with a gold substrate: Validation of interatomic potentials,  Journal of Aerosol Science 159, p. 105846
DOI: 10.1016/j.jaerosci.2021.105846

Luu, H.-T., Dang, S.-L., Hoang, T.-V., Gunkelmann, N. (2021): Molecular dynamics simulation of nanoindentation in Al and Fe: On the influence of system characteristics,  Applied Surface Science 551, p. 149221
DOI: 10.1016/j.apsusc.2021.149221

Rosandi, Y., Luu, H.-T., Urbassek, H. M., Gunkelmann, N. (2020): Molecular Dynamics Simulations of the Mechanical Behavior of Alumina Coated Aluminum Nanowires under Tension and Compression,  RSC Advances 10 (2020), pp. 14353–14359
DOI: 10.1039/D0RA01206H

Luu, H. T. (2023): Molecular dynamics simulations of plastic deformation in iron and aluminum,  Dissertation, Technische Universität Clausthal
DOI: 10.21268/20230214-0

Lyu, S., Merkert, N. (2026): Investigation of Al/Cu Wetting System: A Molecular Dynamics Study,  In: Zhao, T., Khotsyanovskii, A. O. (Hg.): Proceedings of 14th Global Conference on Materials Science and Engineering. Singapore: Springer Nature Singapore, pp. 16–27
DOI: 10.1007/978-981-95-6461-3_2

Gunkelmann, N., Luu, H.-T. (2021): Molekulardynamik-Simulationen von Grenzflächenphänomenen in sauerstofffreier Atmosphäre (Vortrag),  4. Symposium Materialtechnik des CZM

Luu, H. T., Rosandi, Y., Urbassek, H., Gunkelmann, N. (2021): Atomistic Study of the Influence of Oxide Shell Layers on the Material (Vortrag),  4. Symposium Materialtechnik des CZM