Publications
Showing entries 61 - 80 out of 628
2023
Guidolin, C, Heim, C, Adams, NBP, Baaske, P, Rondelli, V, Cerbino, R & Giavazzi, F 2023, 'Protein Sizing with Differential Dynamic Microscopy', Macromolecules, vol. 56, no. 20, pp. 8290-8297. https://doi.org/10.1021/acs.macromol.3c00782
Tröster, A, Pils, J, Bruckner, F, Rychetsky, I, Verdi, C & Schranz, W 2023, 'Hard antiphase domain boundaries in strontium titanate: A comparison of Landau-Ginzburg-Devonshire and ab initio results', Physical Review B, vol. 108, no. 14, 144108. https://doi.org/10.1103/PhysRevB.108.144108
Sappl, L, Likos, CN & Zöttl, A 2023, 'Multi-particle collision dynamics for a coarse-grained model of soft colloids applied to ring polymers', Journal of Chemical Physics, vol. 159, no. 11, 114904. https://doi.org/10.1063/5.0165191
Kývala, L & Dellago, C 2023, 'Optimizing the architecture of Behler-Parrinello neural network potentials', Journal of Chemical Physics, vol. 159, no. 9, 094105. https://doi.org/10.1063/5.0167260
Rychetsky, I, Schranz, W & Tröster, A 2023, 'Landau-Ginzburg-Devonshire theory of the chiral phase transition in 180° domain walls of PbTiO3', Physical Review B, vol. 108, no. 10, 104107. https://doi.org/10.1103/PhysRevB.108.104107
Gorfer, A, Abart, R & Dellago, C 2023, 'A machine learning force field for albite and the diffusion mechanisms of its defects', Paper presented at MinWien2023, Wien, Austria, 17/09/23 - 21/09/23.
Falkner, S, Coretti, A, Romano, S, Geissler, PL & Dellago, C 2023, 'Conditioning Boltzmann generators for rare event sampling', Machine Learning: Science and Technology, vol. 4, no. 3, 035050. https://doi.org/10.1088/2632-2153/acf55c
Novikau, IS, Zverev, VV, Novak, EV & Kantorovich, SS 2023, 'Stockmayer supracolloidal magnetic polymers under the influence of an applied magnetic field and a shear flow', Journal of Molecular Liquids, vol. 384, 122229. https://doi.org/10.1016/j.molliq.2023.122229, https://doi.org/10.48550/arXiv.2306.03005
Alexiou, TS & Likos, CN 2023, 'Effective Interactions between Double-Stranded DNA Molecules in Aqueous Electrolyte Solutions: Effects of Molecular Architecture and Counterion Valency', Journal of Physical Chemistry B, vol. 127, no. 31, pp. 6969-6981. https://doi.org/10.1021/acs.jpcb.3c02216
Bruckner, F, Koraltan, S, Abert, C & Suess, D 2023, 'magnum.np. a PyTorch based GPU enhanced finite difference micromagnetic simulation framework for high level development and inverse design', Scientific Reports, vol. 13, no. 1, 12054. https://doi.org/10.48550/arXiv.2302.08843, https://doi.org/10.1038/s41598-023-39192-5
Sánchez, PA, Caciagli, A, Kantorovich, S & Eiser, E 2023, 'Kinetically limited valence of colloidal particles with surface mobile DNA linkers', Journal of Molecular Liquids, vol. 382, 121895. https://doi.org/10.1016/j.molliq.2023.121895
Nádasi, H, Küster, M, Mertelj, A, Sebastián, N, Hribar Boštjančič, P, Lisjak, D, Viereck, T, Rosenberg, M, Ivanov, AO, Kantorovich, SS, Eremin, A & Ludwig, F 2023, 'Role of ionic surfactant in magnetic dynamics of self-assembled dispersions of nanoplatelets', Journal of Molecular Liquids, vol. 382, 121900. https://doi.org/10.1016/j.molliq.2023.121900
Vörös, D & Mai, S 2023, 'Role of Ultrafast Internal Conversion and Intersystem Crossing in the Nonadiabatic Relaxation Dynamics of ortho-Nitrobenzaldehyde', Journal of Physical Chemistry A, vol. 127, no. 28, pp. 5872-5886. https://doi.org/10.1021/acs.jpca.3c02899
Zöttl, A 2023, 'Dynamics of squirmers in explicitly modeled polymeric fluids', EPL, vol. 143, no. 1, 17003. https://doi.org/10.48550/arXiv.2306.09720, https://doi.org/10.1209/0295-5075/acdf18
Guarini, E, Bafile, U, Colognesi, D, Cunsolo, A, Francesco, AD, Formisano, F, Montfrooij, W, Neumann, M & Barocchi, F 2023, 'Role of the single-particle dynamics in the transverse current autocorrelation function of a liquid metal', Journal of Chemical Physics, vol. 158, no. 23, 234501. https://doi.org/10.1063/5.0152090
Kuznetsov, AA, Novak, EV, Pyanzina, ES & Kantorovich, SS 2023, 'Multicore-based ferrofluids in zero field: initial magnetic susceptibility and self-assembly mechanisms', Soft Matter, vol. 19, no. 24, pp. 4549-4561. https://doi.org/10.1039/D3SM00440F
Vörös, D & Mai, S 2023, 'Excited states of ortho-nitrobenzaldehyde as a challenging case for single- and multi-reference electronic structure theory', Journal of Computational Chemistry, vol. 44, no. 14, pp. 1381-1394. https://doi.org/10.1002/jcc.27093
Montero de Hijes, P, Romano, S, Gorfer, A & Dellago, C 2023, 'The kinetics of the ice-water interface from ab initio machine learning simulations', Journal of Chemical Physics, vol. 158, no. 20, 204706. https://doi.org/10.48550/arXiv.2303.11092, https://doi.org/10.1063/5.0151011
Košovan, P, Landsgesell, J, Nová, L, Uhlík, F, Beyer, D, Blanco, PM, Staňo, R & Holm, C 2023, 'Reply to the ‘Comment on “Simulations of ionization equilibria in weak polyelectrolyte solutions and gels”’ by J. Landsgesell, L. Nová, O. Rud, F. Uhlík, D. Sean, P. Hebbeker, C. Holm and P. Košovan, Soft Matter, 2019, 15, 1155-1185', Soft Matter, vol. 19, pp. 3522-3525. https://doi.org/10.1039/d3sm00155e
Frittoli, E, Palamidessi, A, Iannelli, F, Zanardi, F, Villa, S, Barzaghi, L, Abdo, H, Cancila, V, Beznoussenko, GV, Della Chiara, G, Pagani, M, Malinverno, C, Bhattacharya, D, Pisati, F, Yu, W, Galimberti, V, Bonizzi, G, Martini, E, Mironov, AA, Gioia, U, Ascione, F, Li, Q, Havas, K, Magni, S, Lavagnino, Z, Pennacchio, FA, Maiuri, P, Caponi, S, Mattarelli, M, Martino, S, di Fagagna, FDA, Rossi, C, Lucioni, M, Tancredi, R, Pedrazzoli, P, Vecchione, A, Petrini, C, Ferrari, F, Lanzuolo, C, Bertalot, G, Nader, G, Foiani, M, Piel, M, Cerbino, R, Giavazzi, F, Tripodo, C & Scita, G 2023, 'Tissue fluidification promotes a cGAS-STING cytosolic DNA response in invasive breast cancer', Nature Materials, vol. 22, no. 5, pp. 644–655. https://doi.org/10.1038/s41563-022-01431-x
Showing entries 61 - 80 out of 628