Publications
Showing entries 81 - 100 out of 628
2023
Jung, H, Covino, R, Arjun, A, Leitold, C, Dellago, C, Bolhuis, PG & Hummer, G 2023, 'Machine-guided path sampling to discover mechanisms of molecular self-organization', Nature Computational Science, vol. 3, no. 4, pp. 334–345. https://doi.org/10.1038/s43588-023-00428-z
He, P, Katan, AJ, Tubiana, L, Dekker, C & Michieletto, D 2023, 'Single-Molecule Structure and Topology of Kinetoplast DNA Networks', Physical Review X, vol. 13, no. 2, 021010. https://doi.org/10.48550/arXiv.2209.01293, https://doi.org/10.1103/PhysRevX.13.021010
Dobroserdova, AB, Novak, EV & Kantorovich, SS 2023, 'Switching-field and first-order-reversal-curve distribution measurements in magnetic elastomers by molecular dynamics simulations: Accounting for polydispersity', Physical Review E, vol. 107, no. 4, 044606. https://doi.org/10.1103/PhysRevE.107.044606
Montero De Hijes, P, R Espinosa, J, Vega, C & Dellago, C 2023, 'Minimum in the pressure dependence of the interfacial free energy between ice Ih and water', Journal of Chemical Physics, vol. 158, no. 12, 124503. https://doi.org/10.1063/5.0140814, https://doi.org/10.48550/arXiv.2301.00178
Reiner, MM, Bachmair, B, Tiefenbacher, MX, Mai, S, González, L, Marquetand, P & Dellago, C 2023, 'Nonadiabatic Forward Flux Sampling for Excited-State Rare Events', Journal of Chemical Theory and Computation, vol. 19, no. 6, pp. 1657–1671. https://doi.org/10.1021/acs.jctc.2c01088, https://doi.org/10.48550/arXiv.2208.00686
Helbig, S, Abert, C, Sánchez, PA, Kantorovich, SS & Suess, D 2023, 'Self-consistent solution of magnetic and friction energy losses of a magnetic nanoparticle', Physical Review B, vol. 107, no. 5, 054416. https://doi.org/10.1103/PhysRevB.107.054416
Gorfer, A, Dellago, C & Sega, M 2023, 'High-density liquid (HDL) adsorption at the supercooled water/vapor interface and its possible relation to the second surface tension inflection point', Journal of Chemical Physics, vol. 158, no. 5, 054503. https://doi.org/10.1063/5.0132985
Guarini, E, Neumann, M, Francesco, AD, Formisano, F, Cunsolo, A, Montfrooij, W, Colognesi, D & Bafile, U 2023, 'Onset of collective excitations in the transverse dynamics of simple fluids', Physical Review E, vol. 107, no. 1, 014139. https://doi.org/10.1103/PhysRevE.107.014139
Stano, R, Likos, CN & Smrek, J 2023, 'To thread or not to thread? Effective potentials and threading interactions between asymmetric ring polymers', Soft Matter, vol. 19, no. 1, pp. 17-30. https://doi.org/10.1039/d2sm01177h
2022
Bulavin, LA, Bilous, OI, Chechko, VY & Stula, YM 2022, 'Physical properties of aqueous solutions of 1-propanol near its pequliar point', Journal of Molecular Liquids, vol. 368, no. Part A, 120642. https://doi.org/10.1016/j.molliq.2022.120642
Ubertini, MA, Smrek, J & Rosa, A 2022, 'Entanglement Length Scale Separates Threading from Branching of Unknotted and Non-concatenated Ring Polymers in Melts', Macromolecules, vol. 55, no. 23, pp. 10723–10736. https://doi.org/10.1021/acs.macromol.2c01264
Coretti, A, Baird, T, Vuilleumier, R & Bonella, S 2022, 'Mass-zero constrained dynamics for simulations based on orbital-free density functional theory', Journal of Chemical Physics, vol. 157, no. 21, 214110. https://doi.org/10.1063/5.0130117
Wautischer, G, Abert, C, Bruckner, F, Slanovc, F & Suess, D 2022, 'A topology optimization algorithm for magnetic structures based on a hybrid FEM-BEM method utilizing the adjoint approach', Scientific Reports, vol. 12, no. 1, 1119. https://doi.org/10.1038/s41598-021-04246-z
Zhu, R, Canena, D, Sikora, M, Klausberger, M, Seferovic, H, Mehdipour, AR, Hain, L, Laurent, E, Monteil, V, Wirnsberger, G, Wieneke, R, Tampé, R, Kienzl, NF, Mach, L, Mirazimi, A, Oh, YJ, Penninger, JM, Hummer, G & Hinterdorfer, P 2022, 'Force-tuned avidity of spike variant-ACE2 interactions viewed on the single-molecule level', Nature Communications, vol. 13, no. 1, 7926. https://doi.org/10.1038/s41467-022-35641-3
Tubiana, L, Ferrari, F & Orlandini, E 2022, 'Circular Polycatenanes: Supramolecular Structures with Topologically Tunable Properties', Physical Review Letters, vol. 129, no. 22, 227801. https://doi.org/10.1103/PhysRevLett.129.227801
Coretti, A, Bacon, C, Berthin, R, Serva, A, Scalfi, L, Chubak, I, Goloviznina, K, Haefele, M, Marin-Lafleche, A, Rotenberg, B, Bonella, S & Salanne, M 2022, 'MetalWalls: Simulating electrochemical interfaces between polarizable electrolytes and metallic electrodes', Journal of Chemical Physics, vol. 157, no. 18, 184801. https://doi.org/10.1063/5.0101777
Innerbichler, M, Militaru, A, Frimmer, M, Novotny, L & Dellago, C 2022, 'White-noise fluctuation theorem for Langevin dynamics', New Journal of Physics, vol. 24, no. 11, 113028. https://doi.org/10.1088/1367-2630/ac9ed6
Suppan, M, Huber, C, Mathauer, K, Abert, C, Brucker, F, Gonzalez-Gutierrez, J, Schuschnigg, S, Groenefeld, M, Teliban, I, Kobe, S, Saje, B & Suess, D 2022, 'In-situ alignment of 3D printed anisotropic hard magnets', Scientific Reports, vol. 12, no. 1, 17590. https://doi.org/10.1038/s41598-022-20669-8
Villa, S, Edera, P, Brizioli, M, Trappe, V, Giavazzi, F & Cerbino, R 2022, 'Quantitative rheo-microscopy of soft matter', Frontiers in Physics, vol. 10, 1013805. https://doi.org/10.3389/fphy.2022.1013805
Stolbov, OV, Sánchez, PA, Kantorovich, SS & Raikher, YL 2022, 'Magnetostriction in elastomers with mixtures of magnetically hard and soft microparticles: effects of nonlinear magnetization and matrix rigidity', Physical Sciences Reviews, vol. 7, no. 10, pp. 1187-1208. https://doi.org/10.1515/psr-2020-0009
Showing entries 81 - 100 out of 628