Publications | Dept. Kremer
Journal Article (55)
1.
Journal Article
Modeling of organic light emitting diodes: from molecular to device properties. International Conference on Numerical Simulation of Optoelectronic Devices, pp. 101 - 102 (2017)
2.
Journal Article
6 (10), pp. 1042 - 1046 (2017)
Poly(N-isopropylacrylamide) Microgels under Alcoholic Intoxication: When a LCST Polymer Shows Swelling with Increasing Temperature. ACS Macro Letters 3.
Journal Article
40 (3), 34 (2017)
On the influence of a network on optically isotropic fluid phases with tetrahedral/octupolar order. European Physical Journal E 4.
Journal Article
5, pp. 37 - 43 (2017)
Recent advances in modeling green solvents. Current Opinion in Green and Sustainable Chemistry 5.
Journal Article
146 (3), 034904 (2017)
Effects of stereochemistry and copolymerization on the LCST of PNIPAm. The Journal of Chemical Physics 6.
Journal Article
147 (6), 064904 (2017)
Sequence transferable coarse-grained model of amphiphilic copolymers. The Journal of Chemical Physics 7.
Journal Article
121 (29), pp. 7027 - 7041 (2017)
Coupled Valence-Bond State Molecular Dynamics Description of an Enzyme-Catalyzed Reaction in a Non-Aqueous Organic Solvent. The Journal of Physical Chemistry B 8.
Journal Article
146 (24), 244113 (2017)
Using force-based adaptive resolution simulations to calculate solvation free energies of amino acid sidechain analogues. The Journal of Chemical Physics 9.
Journal Article
146 (4), 049901 (2017)
Erratum: “Adaptive resolution simulation of a biomolecule and its hydration shell: Structural and dynamical properties” [J. Chem. Phys. 142, 195101 (2015)]. The Journal of Chemical Physics 10.
Journal Article
23 (40), pp. 9690 - 9697 (2017)
Nitrated Fatty Acids Modulate the Physical Properties of Model Membranes and the Structure of Transmembrane Proteins. Chemistry – A European Journal 11.
Journal Article
50 (4), pp. 1749 - 1754 (2017)
Nanoparticle Motion in Entangled Melts of Linear and Nonconcatenated Ring Polymers. Macromolecules 12.
Journal Article
147 (14), 144302 (2017)
The effects of halogen elements on the opening of an icosahedral B-12 framework. The Journal of Chemical Physics 13.
Journal Article
5 (2), pp. 350 - 361 (2017)
Charge transport in highly ordered organic nanofibrils: lessons from modelling. Journal of Materials Chemistry C: Materials for Optical and Electronic Devices 14.
Journal Article
8, pp. 968 - 974 (2017)
Scaling law to determine peak forces in tapping-mode AFM experiments on finite elastic soft matter systems. Beilstein Journal of Nanotechnology 15.
Journal Article
96 (5), 053311 (2017)
Scalable and fast heterogeneous molecular simulation with predictive parallelization schemes. Physical Review E 16.
Journal Article
19 (28), pp. 18389 - 18393 (2017)
Topology of internally constrained polymer chains. Physical Chemistry Chemical Physics 17.
Journal Article
11 (9), pp. 9084 - 9092 (2017)
Development of a Virtual Cell Model to Predict Cell Response to Substrate Topography. ACS Nano 18.
Journal Article
226 (4), pp. 693 - 703 (2017)
Detailed analysis of Rouse mode and dynamic scattering function of highly entangled polymer melts in equilibrium. European Physical Journal - Special Topics 19.
Journal Article
9 (2), 48 (2017)
Thermodynamics of a Compressible Maier-Saupe Model Based on the Self-Consistent Field Theory of Wormlike Polymer. Polymers 20.
Journal Article
96 (5), 054113 (2017)
Correlated polarization-switching kinetics in bulk polycrystalline ferroelectrics: A self-consistent mesoscopic switching model. Physical Review B