Li, Xiaoguai, Dirr, Nicolas ![]() |
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Abstract
Continuum modeling of dissipative processes in materials often relies on strong phenomenological assumptions, as their derivation from underlying atomistic/particle models remains a major long-standing challenge. Here we show that the continuum evolution equations of a wide class of dissipative phenomena can be numerically obtained (in a discretized form) from fluctuations via an infinite-dimensional fluctuation-dissipation relation. A salient feature of the method is that these continuum equations can be fully pre-computed, enabling macroscopic simulations of arbitrary admissible initial conditions, without the need of any further microscopic simulations. We test this coarse-graining procedure on a one-dimensional non-linear diffusive process with known analytical solution, and obtain an excellent agreement for the density evolution. This illustrative example serves as a blueprint for a new multiscale paradigm, where full dissipative evolution equations — and not only parameters — can be numerically computed from lower scale data.
Item Type: | Article |
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Date Type: | Publication |
Status: | Published |
Schools: | Mathematics |
Publisher: | Elsevier |
ISSN: | 0022-5096 |
Date of First Compliant Deposit: | 16 July 2019 |
Date of Acceptance: | 30 May 2019 |
Last Modified: | 04 Dec 2024 11:30 |
URI: | https://orca.cardiff.ac.uk/id/eprint/124249 |
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