Hsu, H.-P.; Kremer, K.: Primitive Path Analysis and Stress Distribution in Highly Strained Macromolecules. ACS Macro Letters 7 (1), S. 107 - 111 (2018)

Hsu, H.-P.; Kremer, K.: Chain Retraction in Highly Entangled Stretched Polymer Melts. Physical Review Letters 121 (16), 167801 (2018)

Jorge, M.; Milne, A. W.; Sobek, O. N.; Centi, A.; Perez-Sanchez, G.; Gomes, J. R. B.: Modelling the self-assembly of silica-based mesoporous materials. Molecular Simulation 44 (6), S. 435 - 452 (2018)

Joshi, B.; Beccard, S.; Vilgis, T. A.: Fractals in crystallizing food systems. Current Opinion in Food Science 21, S. 39 - 45 (2018)

Karmakar, T.; Piaggi, P. M.; Perego, C.; Parrinello, M.: A Cannibalistic Approach to Grand Canonical Crystal Growth. Journal of Chemical Theory and Computation 14 (5), S. 2678 - 2683 (2018)

Kling, T.; Kling, F.; Donadio, D.: Structure and Dynamics of the Quasi-Liquid Layer at the Surface of Ice from Molecular Simulations. Journal of Physical Chemistry C 122 (43), S. 24780 - 24787 (2018)

Kotadiya, N. B.; Lu, H.; Mondal, A.; Ie, Y.; Andrienko, D.; Blom, P. W. M.; Wetzelaer, G.-J. A. H.: Universal strategy for Ohmic hole injection into organic semiconductors with high ionization energies. Nature Materials 17 (4), S. 329 - 334 (2018)

Kotadiya, N.; Mondal, A.; Xiong, S.; Blom, P.; Andrienko, D.; Wetzelaer, G.-J.: Rigorous Characterization and Predictive Modeling of Hole Transport in Amorphous Organic Semiconductors. Advanced Electronic Materials 4 (12), 1800366 (2018)

Liu, C.; Kremer, K.; Bereau, T.: Polymorphism of Syndiotactic Polystyrene Crystals from Multiscale Simulations. Advanced theory and simulations 1 (7), 1800024 (2018)

Liu, L.; Lukose, B.; Ensing, B.: A Free Energy Landscape of CO2 Capture by Frustrated Lewis Pairs. ACS Catalysis 8 (4), S. 3376 - 3381 (2018)

Martin, J.; Davidson, E. C.; Greco, C.; Xu, W. M.; Bannock, J. H.; Agirre, A.; de Mello, J.; Segalman, R. A.; Stingelin, N.; Daoulas, K. C.: Temperature-Dependence of Persistence Length Affects Phenomenological Descriptions of Aligning Interactions in Nematic Semiconducting Polymers. Chemistry of Materials 30 (3), S. 748 - 761 (2018)

Menichetti, R.; Kremer, K.; Bereau, T.: Efficient potential of mean force calculation from multiscale simulations: Solute insertion in a lipid membrane. Biochemical and Biophysical Research Communications 498 (2), S. 282 - 287 (2018)

Mondal, A.; Sunda, A. P.: Molecular dynamics simulations of ammonium/phosphonium-based protic ionic liquids: influence of alkyl to aryl group. Physical Chemistry Chemical Physics 20 (28), S. 19268 - 19275 (2018)

Morsbach, S.; Gonella, G.; Mailänder, V.; Wegner, S.; Wu, S.; Weidner, T.; Berger, R.; Koynov, K.; Vollmer, D.; Encinas, N. et al.; Kuan, S. L.; Bereau, T.; Kremer, K.; Weil, T.; Bonn, M.; Butt, H.-J.; Landfester, K.: Engineering Proteins at Interfaces: From Complementary Characterization to Material Surfaces with Designed Functions. Angewandte Chemie International Edition 57 (39), S. 12626 - 12648 (2018)

Mukherji, D.; Marques, C. M.; Kremer, K.: Collapse in two good solvents, swelling in two poor solvents: defying the laws of polymer solubility? Journal of Physics: Condensed Matter 30 (2), 024002 (2018)

Ohkuma, T.; Kremer, K.; Daoulas, K.: Equilibrating high-molecular-weight symmetric and miscible polymer blends with hierarchical back-mapping. Journal of Physics: Condensed Matter 30 (17), 174001 (2018)

Ouyang, B.; Chen, S.; Jing, Y.; Wei, T.; Xiong, S.; Donadio, D.: Enhanced thermoelectric performance of two dimensional MS2 (M = Mo, W) through phase engineering. Journal of materiomics 4 (4), S. 329 - 337 (2018)

Ouyang, B.; Xiong, S.; Jing, Y. H.: Tunable phase stability and contact resistance of monolayer transition metal dichalcogenides contacts with metal. npj 2D Materials and Applications 2, 13 (2018)

Pan, S.; Nguyen, D. A.; Dünweg, B.; Sunthar, P.; Sridhar, T.; Prakash, J. R.: Shear thinning in dilute and semidilute solutions of polystyrene and DNA. Journal of Rheology 62 (4), S. 845 - 867 (2018)

Peköz, R.; Donadio, D.: Selective adsorption of a supramolecular structure on flat and stepped gold surfaces. Surface Science 670, S. 44 - 50 (2018)