Publications


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Locatelli, E, Handle, PH, Likos, CN, Sciortino, F & Rovigatti, L 2017, 'Condensation and Demixing in Solutions of DNA Nanostars and Their Mixtures' ACS Nano, vol. 11, no. 2, pp. 2094-2102. DOI: 10.1021/acsnano.6b08287

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Rovigatti, L, Bianco, V, Tavares, JM & Sciortino, F 2017, 'Communication: Re-entrant limits of stability of the liquid phase and the Speedy scenario in colloidal model systems' Journal of Chemical Physics, vol. 146, no. 4, 041103. DOI: 10.1063/1.4974830

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Cividini, J, Mukamel, D & Posch, HA 2017, 'Driven tracers in narrow channels' Physical Review E, vol. 95, no. 1, 012110. DOI: 10.1103/PhysRevE.95.012110

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Bellissima, S, Neumann, M, Guarini, E, Bafile, U & Barocchi, F 2017, 'Density of states and dynamical crossover in a dense fluid revealed by exponential mode analysis of the velocity autocorrelation function' Physical Review E, vol. 95, no. 1, 012108. DOI: 10.1103/PhysRevE.95.012108

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Hasnain, J, Menzl, G, Jungblut, S & Dellago, C 2017, 'Crystallization and flow in active patch systems' Soft Matter, vol. 13, no. 5, pp. 930-936. DOI: 10.1039/c6sm01898j

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Roldan-Vargas, S, Rovigatti, L & Sciortino, F 2017, 'Connectivity, dynamics, and structure in a tetrahedral network liquid' Soft Matter, vol. 13, no. 2, pp. 514-530. DOI: 10.1039/c6sm02282k

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Qin, L, Redermeier, A, Kozeschnik, E, Karner, C & Dellago, C 2017, A statistical methodology to reconstruct nucleation pathways in the Fe-Cu system. in THERMEC 2016. Materials Science Forum, vol.. 879, TRANS TECH PUBLICATIONS LTD, pp. 1529-1534, 9th International Conference on Processing and Manufacturing of Advanced Materials, THERMEC 2016, Graz, Austria, 29-3 June. DOI: 10.4028/www.scientific.net/MSF.879.1529

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Lüsebrink, D, Cerdà, JJ, Sánchez, PA, Kantorovich, S & Sintes, T 2016, 'The behavior of a magnetic filament in flow under the influence of an external magnetic field' Journal of Chemical Physics, vol. 145, no. 23, 234902. DOI: 10.1063/1.4971860

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Menzl, G & Dellago, C 2016, 'Effect of entropy on the nucleation of cavitation bubbles in water under tension' Journal of Chemical Physics, vol. 145, no. 21, 211918. DOI: 10.1063/1.4964327

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Sega, M, Fabian, B, Horvai, G & Jedlovszky, P 2016, 'How Is the Surface Tension of Various Liquids Distributed along the Interface Normal?' The Journal of Physical Chemistry Part C (Nanomaterials and Interfaces), vol. 120, no. 48, pp. 27468-27477. DOI: 10.1021/acs.jpcc.6b09880

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Montessori, A, Amadei, CA, Falcucci, G, Sega, M, Vecitis, CD & Succi, S 2016, 'Extended friction elucidates the breakdown of fast water transport in graphene oxide membranes' Europhysics Letters, vol. 116, no. 5, 54002. DOI: 10.1209/0295-5075/116/54002

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Menzl, G, Gonzalez, MA, Geiger, P, Caupin, F, Abascal, JLF, Valeriani, C & Dellago, C 2016, 'Molecular mechanism for cavitation in water under tension' Proceedings of the National Academy of Sciences of the United States of America (PNAS), vol. 113, no. 48, pp. 13582-13587. DOI: 10.1073/pnas.1608421113

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Locatelli, E, Capone, B & Likos, CN 2016, 'Multiblob coarse-graining for mixtures of long polymers and soft colloids' Journal of Chemical Physics, vol. 145, no. 17, 174901. DOI: 10.1063/1.4965957

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Borrero, EE & Dellago, C 2016, 'Avoiding traps in trajectory space: Metadynamics enhanced transition path sampling' European Physical Journal. Special Topics, vol. 225, no. 8-9, pp. 1609-1620. DOI: 10.1140/epjst/e2016-60106-y

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Najafi, S, Podgornik, R, Potestio, R & Tubiana, L 2016, 'Role of Bending Energy and Knot Chirality in Knot Distribution and Their Effective Interaction along Stretched Semiflexible Polymers' Polymers, vol. 8, no. 10, 347. DOI: 10.3390/polym8100347

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Bianco, V & Malgaretti, P 2016, 'Non-monotonous polymer translocation time across corrugated channels: Comparison between Fick-Jacobs approximation and numerical simulations' Journal of Chemical Physics, vol. 145, no. 11, 114904. DOI: 10.1063/1.4961697

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Jehser, M & Likos, C 2016, DPD study of Polymer Loops and Tails attached to a Surface. in Book of Abstracts. pp. P01-178, 4th International Soft Matter Conference (ISMC2016), Grenoble, France, 12-16 September.

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Sega, M 2016, 'The role of a small-scale cutoff in determining molecular layers at fluid interfaces' Physical Chemistry Chemical Physics - PCCP, vol. 18, no. 33, pp. 23354-23357. DOI: 10.1039/c6cp04788b

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Jungblut, S & Dellago, C 2016, 'Heterogeneous Crystallization on Pairs of Pre-Structured Seeds' The Journal of Physical Chemistry Part B: Condensed Matter, Materials, Surfaces, Interfaces & Biophysical, vol. 120, no. 34, pp. 9230-9239. DOI: 10.1021/acs.jpcb.6b06510

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Sega, M, Fabian, B & Jedlovszky, P 2016, 'Pressure Profile Calculation with Mesh Ewald Methods' Journal of Chemical Theory and Computation, vol. 12, no. 9, pp. 4509-4515. DOI: 10.1021/acs.jctc.6b00576

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Fernandez-Castanon, J, Bomboi, F, Rovigatti, L, Zanatta, M, Paciaroni, A, Comez, L, Porcar, L, Jafta, CJ, Fadda, GC, Bellini, T & Sciortino, F 2016, 'Small-angle neutron scattering and molecular dynamics structural study of gelling DNA nanostars' Journal of Chemical Physics, vol. 145, no. 8, 084910. DOI: 10.1063/1.4961398

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Leitold, C & Dellago, C 2016, 'Nucleation and structural growth of cluster crystals' Journal of Chemical Physics, vol. 145, no. 7, 074504. DOI: 10.1063/1.4960958

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Jungblut, S & Dellago, C 2016, 'Pathways to self-organization: Crystallization via nucleation and growth' European Physical Journal E. Soft Matter, vol. 39, no. 8, 77. DOI: 10.1140/epje/i2016-16077-6

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Morawietz, T, Singraber, A, Dellago, C & Behler, J 2016, 'How van der Waals interactions determine the unique properties of water' Proceedings of the National Academy of Sciences of the United States of America (PNAS), vol. 113, no. 30, pp. 8368-8373. DOI: 10.1073/pnas.1602375113

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Ivanov, AO, Kantorovich, S, Zverev, VS, Elfimova, EA, Lebedev, AV & Pshenichnikov, AF 2016, 'Temperature-dependent dynamic correlations in suspensions of magnetic nanoparticles in a broad range of concentrations: a combined experimental and theoretical study' Physical Chemistry Chemical Physics - PCCP, vol. 18, no. 27, pp. 18342-18352. DOI: 10.1039/C6CP02793H

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Sindt, JO, Camp, PJ, Kantorovich, SS, Elfimova, EA & Ivanov, AO 2016, 'Influence of dipolar interactions on the magnetic susceptibility spectra of ferrofluids' Physical Review E, vol. 93, no. 6, 063117. DOI: 10.1103/PhysRevE.93.063117

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Nerattini, F, Chelli, R & Procacci, P 2016, 'II. Dissociation free energies in drug-receptor systems via nonequilibrium alchemical simulations: application to the FK506-related immunophilin ligands' Physical Chemistry Chemical Physics - PCCP, vol. 18, no. 22, pp. 15005-15018. DOI: 10.1039/c5cp05521k

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Wirnsberger, P, Fijan, D, Saric, A, Neumann, M, Dellago, C & Frenkel, D 2016, 'Non-equilibrium simulations of thermally induced electric fields in water' Journal of Chemical Physics, vol. 144, no. 22, 224102. DOI: 10.1063/1.4953036

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Jain, V, Gieseler, J, Moritz, C, Dellago, C, Quidant, R & Novotny, L 2016, 'Direct Measurement of Photon Recoil from a Levitated Nanoparticle' Physical Review Letters, vol. 116, no. 24, 243601. DOI: 10.1103/PhysRevLett.116.243601

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Guarini, E, Neumann, M, Bafile, U, Celli, M, Colognesi, D, Bellissima, S, Farhi, E & Calzavara, Y 2016, 'Velocity autocorrelation by quantum simulations for direct parameter-free computations of the neutron cross sections. II. Liquid deuterium' Physical Review B, vol. 93, no. 22, 224302. DOI: 10.1103/PhysRevB.93.224302

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Najafi, S, Tubiana, L, Podgornik, R & Potestio, R 2016, 'Chirality modifies the interaction between knots' Europhysics Letters, vol. 114, no. 5, 50007. DOI: 10.1209/0295-5075/114/50007

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Lenz, DA, Mladek, B, Likos, CN & Blaak, R 2016, 'Thermodynamic stability and structural properties of cluster crystals formed by amphiphilic dendrimers' Journal of Chemical Physics, vol. 144, no. 20, 204901. DOI: 10.1063/1.4950953

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Cerdà, JJ, Sánchez, PA, Lüsebrink, D, Kantorovich, S & Sintes, T 2016, 'Flexible magnetic filaments under the influence of external magnetic fields in the limit of infinite dilution' Physical Chemistry Chemical Physics - PCCP, vol. 18, pp. 12616-12625. DOI: 10.1039/C6CP00923A

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Mahynski, NA, Rovigatti, L, Likos, CN & Panagiotopoulos, AZ 2016, 'Bottom-Up Colloidal Crystal Assembly with a Twist' ACS Nano, vol. 10, no. 5, pp. 5459-5467. DOI: 10.1021/acsnano.6b01854

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Biagi, S, Rovigatti, L, Sciortino, F & Misbah, C 2016, 'Surface wave excitations and backflow effect over dense polymer brushes' Scientific Reports, vol. 6, 22257. DOI: 10.1038/srep22257

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Rovigatti, L, Capone, B & Likos, C 2016, 'Soft self-assembled nanoparticles with temperature dependent properties' Nanoscale, vol. 8, no. 6, pp. 3288 – 3295. DOI: 10.1039/c5nr04661k

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Sánchez, PA, Smiatek, J, Qiao, B, Sega, M & Holm, C 2016, Atomistic simulation of oligoelectrolyte multilayers growth. in WE Nagel, DH Kröner & MM Resch (eds), High Performance Computing in Science and Engineering '15: Transactions of the High Performance Computing Center, Stuttgart (HLRS) 2015. Springer, pp. 215-228. DOI: 10.1007/978-3-319-24633-8_14

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Snodin, BEK, Romano, F, Rovigatti, L, Ouldridge, TE, Louis, AA & Doye, JPK 2016, 'Direct Simulation of the Self-Assembly of a Small DNA Origami' ACS Nano, vol. 10, no. 2, pp. 1724-1737. DOI: 10.1021/acsnano.5b05865

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Sánchez, PA, Pyanzina, ES, Novak, EV, Cerdà, JJ, Sintes, T & Kantorovich, SS 2016, 'Magnetic filament brushes: tuning the properties of a magnetoresponsive supramolecular coating' Faraday Discussions, vol. 186, pp. 241-263. DOI: 10.1039/C5FD00133A

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Steinbach, G, Nissen, D, Albrecht, M, Novak, E, Sanchez, PA, Kantorovich, S, Gemming, S & Erbe, A 2016, 'Bistable self-assembly in homogeneous colloidal systems for flexible modular architectures' Soft Matter, vol. 12, no. 10, pp. 2737-2743. DOI: 10.1039/C5SM02899J

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Potestio, R & Tubiana, L 2016, 'Discretized knot motion on a tensioned fiber induced by transverse waves' Soft Matter, vol. 12, no. 3, pp. 669-673. DOI: 10.1039/c5sm01766a

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Nabavi, SS & Hartmann, MA 2016, 'Weak reversible cross links may decrease the strength of aligned fiber bundles' Soft Matter, vol. 12, no. 7, pp. 2047-2055. DOI: 10.1039/c5sm02614h

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Poier, P, Bacova, P, Moreno, AJ, Likos, CN & Blaak, R 2016, 'Anisotropic effective interactions and stack formation in mixtures of semiflexible ring polymers' Soft Matter, vol. 12, no. 21, pp. 4805-4820. DOI: 10.1039/c6sm00430j

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Poier, P, Egorov, SA, Likos, CN & Blaak, R 2016, 'Concentration-induced planar-to-homeotropic anchoring transition of stiff ring polymers on hard walls' Soft Matter, vol. 12, no. 38, pp. 7983-7994. DOI: 10.1039/c6sm01453d

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Jungblut, S & Dellago, C 2016, Pathways to self-organization: Crystallization via nucleation and growth. in CN Likos, F Sciortino, P Ziherl & E Zaccarelli (eds), Soft Matter Self-Assembly. Proceedings of the International School of Physics "Enrico Fermi", vol.. 193, IOS Press, pp. 217-290, International School of Physics Enrico Fermi, Italy, 29-7 July. DOI: 10.3254/978-1-61499-662-0-217

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Likos, CN 2016, Depletion interactions on soft colloids: Glass formation, melting and demixing. in CN Likos, F Sciortino, P Ziherl & E Zaccarelli (eds), Soft Matter Self-Assembly. Proceedings of the International School of Physics "Enrico Fermi", vol.. 193, IOS Press, pp. 57-80, International School of Physics Enrico Fermi, Italy, 29-7 July. DOI: 10.3254/978-1-61499-662-0-57

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Kantorovich, SS & Ivanov, AO 2016, The influence of self-assembly on the magnetic response of dipolar soft systems. in CN Likos, F Sciortino, P Ziherl & E Zaccarelli (eds), Soft Matter Self-Assembly. Proceedings of the International School of Physics "Enrico Fermi", vol.. 193, IOS Press, pp. 137-163, International School of Physics Enrico Fermi, Italy, 29-7 July. DOI: 10.3254/978-1-61499-662-0-137

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Voyiatzis, E & Böhm, MC 2016, 'How does the entropy of ternary polymer-solvent-cosolvent mixtures depend on the molar solvent fraction?' RSC Advances , vol. 6, no. 99, pp. 97018-97021. DOI: 10.1039/c6ra23340f

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Kumaraswamy, G, Manoharan, VN, Singh, J, Bachhar, N, Kulkarni, S, Bandyopadhyay, R, Punnathanam, S, Srivastav, A, Roy Chowdhury, P, Frenkel, D, Kumar, GVP, Sridurai, V, Dhabal, D, Eiser, E, Tripathy, M, Edwards, A, Prasad, BLV, Basavaraj, MG, Yadav, HOS, Walker, L, Kumar, S, Chakravarty, C, Shinde, V, Bandyopadhyaya, R, Jestin, J, Laradji, M, Kantorovich, S, Kotov, N, Gang, O, Kumar, S, Botet, R, Kolli, HB, Joshi, YM & Sánchez, PA 2016, 'Modeling and Theory: general discussion' Faraday Discussions, vol. 186, pp. 371-398. DOI: 10.1039/C6FD90002J

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Gieseler, J, Jain, V, Moritz, C, Dellago, C, Quidant, R & Novotny, L 2016, Microscopic thermodynamics with levitated nanoparticles. in Optical Trapping and Optical Micromanipulation XIII., 992208, Proceedings of SPIE, vol.. 9922, SPIE-INT SOC OPTICAL ENGINEERING, Conference on Optical Trapping and Optical Micromanipulation XIII, San Diego, United States, 28-1 September. DOI: 10.1117/12.2237380

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