Search arXiv⌕ Search

arXiv · 2610.32895

Time-temperature superposition from multi-temperature chirp rheometry of thermorheologically simple materials via physics-informed Gaussian processes

Abstract

Inferring constitutive laws from transient response data is a central inverse problem in soft condensed-matter physics, particularly when the relevant relaxation spectrum extends beyond the time window of a single experiment. Time-temperature superposition (TTS) constrains this problem for thermorheologically simple materials in the linear viscoelastic regime by allowing temperature to rescale the characteristic relaxation time without changing the underlying shape of the relaxation spectrum. We incorporate this constraint into a physics-informed machine-learning framework for time-resolved mechanical spectroscopy via chirp rheometry. We encode compact fractional viscoelastic models as causal convolutional features derived from the Boltzmann superposition principle, and we jointly fit multi-temperature chirp records using sparse variational Gaussian process regression. The model infers horizontal shift factors, constitutive parameters, and an observational-noise scale directly from time-domain stress-strain signals measured in the linear viscoelastic regime, without first extracting frequency-domain spectra or manually shifting separate curves. For synthetic Fractional Maxwell data, the method recovers the generating constitutive law from a prescribed model library and latent shifts over stress-noise levels from 3% to 25%. Applied to a DGEBA-IPDA epoxy dataset spanning the glass-transition regime, the pooled likelihood distinguishes competing fractional rheology models using the Bayesian information criterion. These results recast TTS master-curve construction as probabilistic inference over latent time rescaling and linear viscoelasticity, while also identifying limitations, such as homoscedastic noise and weakly informative spectral regimes.

Explore related subjects

Keep this discovery

Explore connections, maps & timelines

BibTeXRIS

Isaac Y. Miranda-Valdez, Kourosh Mobredi, Juha Koivisto, Mikko J. Alava. 2026-10-23. Time-temperature superposition from multi-temperature chirp rheometry of thermorheologically simple materials via physics-informed Gaussian processes. https://arxiv.org/abs/2610.32895

Cite the original work for its findings. Save a collection to share your selection of sources.

KEEP EXPLORING

Related papers

Dissipation and microstructure in sheared active suspensions of squirmers

We study the energy expenditure and structural correlations in semi-dilute to concentrated suspensions of squirmers using active fast Stokesian dynamics simulations. Specifically, we simulate apolar active suspensions of squirmers, or 'shakers,' and show that shear enhances the total dissipation but reduces the relative viscosity for both puller- and pusher-type shakers. At low shear rates where activity dominates, hydrodynamic interactions increase the active dissipation, more so for pullers at higher volume fractions, whereas pushers exhibit a higher viscosity, in contrast to bacterial suspensions displaying a 'superfluid' transition. At high shear rates where shear dominates, pullers and pushers behave effectively as passive spheres, generating negative normal stress differences due to shear-induced collision. Remarkably, the rate-dependent rheological responses are accompanied by unusual microstructural signatures of an enhanced nematic order and anisotropic pair correlation, both of which contribute to a higher viscosity under shear. Further simulations of self-propelled, neutral squirmers exhibit similar but weaker shear-thinning, highlighting the importance of activity over motility, underpinned by hydrodynamic interactions. Overall, our results elucidate the interplay of internal activity and external flow on the dissipation and microstructure in sheared active suspensions of squirmers.

cond-mat.soft↗

Analyzing the Gelation Transition through Fractional Viscoelasticity and the Mittag-Leffler-Prabhakar Function

The gelation transition, a process that transforms a flowable liquid into an elastic solid, occurs in a variety of systems, ranging from colloidal to polymeric. During the gelation transition, a system passes through a critical gel state characterized by scale-free power-law viscoelasticity. Interestingly, the fractional calculus provides a natural mathematical language for such power-law viscoelasticity. In this work, we develop physically constrained fractional viscoelastic models, as well as those based on the three-parameter Mittag-Leffler-Prabhakar function, for both the pre-gel and post-gel regimes, ensuring consistency with the conventional scaling relations in each regime. While the fractional pre-gel model is observed to be valid only for a restricted subset of parameter values, the Prabhakar function-based model for the relaxation modulus, which translates into a Havriliak-Negami function-based complex modulus, rigorously removes this limitation. We enforce continuity of the dynamic moduli and their derivatives across the critical gel point, which universally imposes a symmetry in the relaxation dynamics on either side of the critical gel state. Such enforcement further validates the hyperscaling relation connecting the critical exponents, making it a theoretical necessity rather than an empirical coincidence. We validate the proposed models against time- and frequency-domain experimental data. A model-agnostic, frequency-independent rheological fingerprint of the critical gel state, uniquely determined by two critical exponents, is also identified.

cond-mat.soft↗

A neural density functional for polymer electrolytes with exact structure and transferable Coulomb coupling

Ion correlations set the structure of polymer electrolytes and depend on the host permittivity, which is low and varies between polymers. A functional that carries these correlations from molecular simulations to larger inhomogeneous systems must transfer across domain sizes, geometries and coupling strengths. We introduce a neural density functional for the ions of a salt-doped polymer melt with built-in integrability, continuous spatial symmetry, the Noether identities, perfect screening in stable bulk states, and parameters that refer to no grid or box. The permittivity enters only through the Bjerrum length, an explicit argument constrained by an exact relation: the free-energy derivative with respect to the Bjerrum length is the Coulomb correlation energy. Trained by force matching on planar profiles at five Bjerrum lengths spanning 8-30 monomer diameters, the functional predicts, without retraining, density profiles in fourfold longer boxes and under two-dimensional fields, bulk structure factors and the long-wavelength number response, also at a concentration and a permittivity left out of training. It reproduces this energy identity on Coulomb energies that never enter the training. Its nonlinear density dependence captures correlations that a quadratic pair closure misses: the number response grows several-fold with concentration, and at low concentration the coupling lowers it through ion association, below the ideal value at the strongest coupling, while the host sets it in the concentrated melt. At fixed coupling, it is more accurate than three neural architectures and loses little accuracy with a quarter of the training data.

cond-mat.soft↗