Publications

Mesoscale modelling of polymer-mediated adhesion: application to tack tests (2025)
A.P. Sgouros, S. Knippenberg, A. Bocahut, P. M. Rauscher, B. Sikora, S. Caputo, H.-S. Choi, V. Finsy, M. Guillaume, D. N. Theodorou. Mol. Syst. Des. Eng.

Understanding relaxation times in supercooled liquids and glasses (2025)
P. M. Rauscher. Phys. Rev. E

Renormalized one-loop theory of correlations in disperse polymer blends (2023)
P. M. Rauscher. J. Chem. Phys. Emerging Investigators Special Collection.

Random Knotting in Fractal Ring Polymers (2022)
P. M. Rauscher, J. J. de Pablo. Macromolecules.

Nonequilibrium statistical thermodynamics of multicomponent interfaces (2022)
P. M. Rauscher, H.C. Öttinger, J. J. de Pablo. Proc. Natl. Acad. Sci.

In silico active learning for small molecule properties (2022)
L. Schneider, M. Schwarting, J. Mysona, H. Liang, M. Han, P. M. Rauscher, J. M. Ting, S. Venkatram, R. B. Ross, K. J. Schmidt, B. Blaiszik, I. Foster, J. J. de Pablo. Mol. Sys. Des. Eng.

Polycatenanes: synthesis, characterization, and physical understanding (2022)
G. Liu, P. M. Rauscher, B. W. Rawe, M. M. Tranquilli, S. J. Rowan. Chem. Soc. Rev.

Metastable doubly threaded [3]rotaxanes with a large macrocycle (2022)
J. E. Hertzog, V. J. Maddi, L. F. Hart, B. W. Rawe, P. M. Rauscher, K. M. Herbert, E. P. Bruckner, J. J. de Pablo, S. J. Rowan. Chemical Science.

Material properties and applications of mechanically interlocked polymers (2021)
L. F. Hart, J. E. Hertzog, P. M. Rauscher, B. W. Rawe, M. M. Tranquilli, S. J. Rowan. Nat. Rev. Mater.

Hydrodynamic interactions in topologically linked ring polymers (2020)
P. M. Rauscher, S. J. Rowan, J. J. de Pablo. Phys. Rev. E.

Crossover from Rouse to Reptation Dynamics in Salt-Free Polyelectrolyte Complex Coacervates (2020)
B. Yu, P. M. Rauscher, N. E. Jackson, A. M. Rumyantsev, J. J. de Pablo. ACS Macro Lett.

Dynamics of poly[n]catenane melts (2020)
P. M. Rauscher, K. S. Schweizer, S. J. Rowan, J. J. de Pablo. J. Chem. Phys. Editor’s Choice.

Thermodynamics and Structure of Poly[n]catenane Melts (2020)
P. M. Rauscher, K. S. Schweizer, S. J. Rowan, J. J. de Pablo. Macromolecules. Journal Cover.

Topological Effects in Isolated Poly[n]catenanes: Molecular Dynamics Simulations and Rouse Mode Analysis (2018)
P. M. Rauscher, S. J. Rowan, J. J. de Pablo. ACS Macro Lett.

Poly[n]catenanes: Synthesis of molecular interlocked chains (2017)
Q. Wu, P. M. Rauscher, X. Lang, R. J. Wojtecki, J. J. de Pablo, M. J. A. Hore, S. J. Rowan. Science.

Effect of Adjacent Rubbery Layers on the Physical Aging of Glassy Polymers (2013)
P. M. Rauscher, J. E. Pye, R. R. Baglay, C. B. Roth. Macromolecules.