Publications of NIC projects 2024

Allmann-Rahn, F. ; Lautenbach, S. ; Deisenhofer, M. ; Grauer, R.
The muphyII code: Multiphysics plasma simulation on large HPC systems
Computer Physics Communications 296, 109064 (2024), 10.1016/j.cpc.2023.109064

Arca sedda, Manuel ; Kamlah, Albrecht W H ; Spurzem, Rainer ; Rizzuto, Francesco Paolo ; Giersz, Mirek ; Naab, Thorsten ; Berczik, Peter
The dragon-II simulations – III. Compact binary mergers in clusters with up to 1 million stars: mass, spin, eccentricity, merger rate, and pair instability supernovae rate
Monthly Notices of the Royal Astronomical Society 528, 5140-5159 (2024), 10.1093/mnras/stad3951

Arca Sedda, Manuel ; Kamlah, Albrecht W H ; Spurzem, Rainer ; Giersz, Mirek ; Berczik, Peter ; Rastello, Sara ; Iorio, Giuliano ; Mapelli, Michela ; Gatto, Massimiliano ; Grebel, Eva K
The dragon-II simulations – I. Evolution of single and binary compact objects in star clusters with up to 1 million stars
Monthly Notices of the Royal Astronomical Society 528, 5119-5139 (2024), 10.1093/mnras/stad3952

Berczik, P. ; Sobolenko, M. ; Ishchenko, M.
Dynamical evolution timescales for the triple supermassive black hole system in NGC 6240
Astronomy & Astrophysics 687, L18 (2024), 10.1051/0004-6361/202450141

Borsányi, Szabolcs ; Fodor, Zoltán ; Guenther, Jana N. ; Katz, Sándor D. ; Parotto, Paolo ; Pásztor, Attila ; Pesznyák, Dávid ; Szabó, Kálmán K. ; Wong, Chik Him
Continuum-extrapolated high-order baryon fluctuations
Physical Review D 110, (2024), 10.1103/PhysRevD.110.L011501

Chen, Ao ; Heyl, Markus
Empowering deep neural quantum states through efficient optimization
Zenodo , (2024), 10.5281/zenodo.7657551

Colliard-Granero, André ; Gompou, Keusra A. ; Rodenbücher, Christian ; Malek, Kourosh ; Eikerling, Michael H. ; Eslamibidgoli, Mohammad J.
Deep learning-enhanced characterization of bubble dynamics in proton exchange membrane water electrolyzers
Physical Chemistry Chemical Physics 26, 14529-14537 (2024), 10.1039/d3cp05869g

Elhatisari, Serdar ; Bovermann, Lukas ; Ma, Yuan-Zhuo ; Epelbaum, Evgeny ; Frame, Dillon ; Hildenbrand, Fabian ; Kim, Myungkuk ; Kim, Youngman ; Krebs, Hermann ; Lähde, Timo A. ; Lee, Dean ; Li, Ning ; Lu, Bing-Nan ; Meißner, Ulf-G. ; Rupak, Gautam ; Shen, Shihang ; Song, Young-Ho ; Stellin, Gianluca
Wavefunction matching for solving quantum many-body problems
Nature 630, 59-63 (2024), 10.1038/s41586-024-07422-z

Finger, C. ; Löer, K.
Depth of Sudden Velocity Changes Derived From Multi‐Mode Rayleigh Waves
Journal of Geophysical Research: Solid Earth 129, (2024), 10.1029/2023JB028322

Friedrich, J. ; Wilbert, M. ; Marino, R.
Nonlocal contributions to the turbulent cascade in magnetohydrodynamic plasmas
Physical Review E 109, (2024), 10.1103/PhysRevE.109.045208

Lübke, Jeremiah ; Effenberger, Frederic ; Wilbert, Mike ; Fichtner, Horst ; Grauer, Rainer
Towards synthetic magnetic turbulence with coherent structures
Europhysics Letters 146, 43001 (2024), 10.1209/0295-5075/ad438f

Mendes-Santos, T. ; Schmitt, M. ; Angelone, A. ; Rodriguez, A. ; Scholl, P. ; Williams, H. J. ; Barredo, D. ; Lahaye, T. ; Browaeys, A. ; Heyl, M. ; Dalmonte, M.
Wave-Function Network Description and Kolmogorov Complexity of Quantum Many-Body Systems
Physical Review X 14, (2024), 10.1103/PhysRevX.14.021029

Methorst, Jeroen ; van Hilten, Niek ; Hoti, Art ; Stroh, Kai Steffen ; Risselada, Herre Jelger
When Data Are Lacking: Physics-Based Inverse Design of Biopolymers Interacting with Complex, Fluid Phases
Journal of Chemical Theory and Computation 20, 1763-1776 (2024), 10.1021/acs.jctc.3c00874

Montañez-Barrera, J A ; Willsch, Dennis ; Maldonado-Romo, A ; Michielsen, Kristel
Unbalanced penalization: a new approach to encode inequality constraints of combinatorial problems for quantum optimization algorithms
Quantum Science and Technology 9, 025022 (2024), 10.1088/2058-9565/ad35e4

Neyers, Christian ; Brockmann, Jan Martin
Radial surface currents from space: An opportunity for mean dynamic topography estimation?
Advances in Space Research , (2024), 10.1016/j.asr.2024.05.041

Nitsche, Valentin ; Höfner, Georg ; Kaiser, Jesko ; Gertzen, Christoph G.W. ; Seeger, Thomas ; Niessen, Karin V. ; Steinritz, Dirk ; Worek, Franz ; Gohlke, Holger ; Paintner, Franz F. ; Wanner, Klaus T.
MS Binding Assays with UNC0642 as reporter ligand for the MB327 binding site of the nicotinic acetylcholine receptor
Toxicology Letters 392, 94-106 (2024), 10.1016/j.toxlet.2024.01.003

Opel, Lana ; Schindelegger, Michael ; Ray, Richard D.
A likely role for stratification in long-term changes of the global ocean tides
Communications Earth & Environment 5, 261 (2024), 10.1038/s43247-024-01432-5

Rieger, Maximilian ; Reh, Moritz ; Gärttner, Martin
Sample-efficient estimation of entanglement entropy through supervised learning
Physical Review A 109, (2024), 10.1103/PhysRevA.109.012403

Scheel, Thomas ; Malgaretti, Paolo ; Harting, Jens
Enhancement of bubble transport in porous electrodes and catalysts
The Journal of Chemical Physics 160, (2024), 10.1063/5.0206381

Schulz, Sebastian ; Willsch, Dennis ; Michielsen, Kristel
Guided quantum walk
Physical Review Research 6, (2024), 10.1103/PhysRevResearch.6.013312

Song, Jiaxing ; Shishkina, Olga ; Zhu, Xiaojue
Scaling regimes in rapidly rotating thermal convection at extreme Rayleigh numbers
Journal of Fluid Mechanics 984, (2024), 10.1017/jfm.2024.249

Song, Jiaxing ; Shishkina, Olga ; Zhu, Xiaojue
Direct numerical simulations of rapidly rotating Rayleigh–Bénard convection with Rayleigh number up to
Journal of Fluid Mechanics 989, (2024), 10.1017/jfm.2024.484

Sovetkin, Evgenii ; Gerber, Andreas ; Pieters, Bart E.
Fast Horizon Approximation: Impacts on Integrated Photovoltaic Irradiation Simulations
Solar RRL , (2024), 10.1002/solr.202400474

Sovetkin, Evgenii ; Gerber, Andreas ; Pieters, Bart E.
Improving horizon computation algorithm with quasirandom sequences
International Journal of Geographical Information Science , (2024), 10.1080/13658816.2024.2408751

Spencer, Russell K. W. ; Santos-Pérez, Isaac ; Rodríguez-Renovales, Izaro ; Martinez Galvez, Juan Manuel ; Shnyrova, Anna V. ; Müller, Marcus
Membrane fission via transmembrane contact
Nature Communications 15, (2024), 10.1038/s41467-024-47122-w

Spencer, Russell K.W. ; Smirnova, Yuliya G. ; Soleimani, Alireza ; Müller, Marcus
Transient pores in hemifusion diaphragms
Biophysical Journal , (2024), 10.1016/j.bpj.2024.06.009

Tipp, Fabian P. ; Fraser, Kate ; Eslamibidgoli, Mohammad J. ; Malek, Kourosh ; Holdcroft, Steven ; Eikerling, Michael H.
Stability Descriptors for (Benz)imidazolium-Based Anion Exchange Membranes
Macromolecules 57, 1734-1743 (2024), 10.5281/zenodo.10184579

van Hilten, Niek ; Verwei, Nino ; Methorst, Jeroen ; Nase, Carsten ; Bernatavicius, Andrius ; Risselada, Herre Jelger
PMIpred: a physics-informed web server for quantitative protein–membrane interaction prediction
Bioinformatics 40, (2024), 10.1093/bioinformatics/btae069

Vert, Daniel ; Willsch, Madita ; Yenilen, Berat ; Sirdey, Renaud ; Louise, Stéphane ; Michielsen, Kristel
Benchmarking quantum annealing with maximum cardinality matching problems
Frontiers in Computer Science 6, (2024), 10.3389/fcomp.2024.1286057

Wesenberg, Lucia ; Müller, Marcus
Role of Interaction Range and Buoyancy on the Adhesion of Vesicles
Langmuir , (2024), 10.1021/acs.langmuir.3c02715