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Inverse design of soft materials via a deep learning-based evolutionary strategy.

ABSTRACT: Colloidal self-assembly—the spontaneous organization of colloids into ordered structures—has been considered key to produce next-generation materials. However, the present-day staggering variety of colloidal building blocks and the limitless number of thermodynamic conditions make a systematic exploration intractable. The true challenge in this field is to turn this logic around and to develop a robust, versatile algorithm to inverse design colloids that self-assemble into a target structure. Here, we introduce a generic inverse design method to efficiently reverse-engineer crystals, quasicrystals, and liquid crystals by targeting their diffraction patterns. Our algorithm relies on the synergetic use of an evolutionary strategy for parameter optimization, and a convolutional neural network as an order parameter, and provides a way forward for the inverse design of experimentally feasible colloidal interactions, specifically optimized to stabilize the desired structure.

SUBMITTER: Coli GM

PROVIDER: S-EPMC8769546 | biostudies-literature | 2022 Jan

REPOSITORIES: biostudies-literature

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Inverse design of soft materials via a deep learning-based evolutionary strategy.

Coli Gabriele M GM Boattini Emanuele E Filion Laura L Dijkstra Marjolein M

Science advances 20220119 3

Colloidal self-assembly—the spontaneous organization of colloids into ordered structures—has been considered key to produce next-generation materials. However, the present-day staggering variety of colloidal building blocks and the limitless number of thermodynamic conditions make a systematic exploration intractable. The true challenge in this field is to turn this logic around and to develop a robust, versatile algorithm to inverse design colloids that self-assemble into a target structure. He ...[more]

PMID: 35044828

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Project description:The growing interest in soft robotics has resulted in an increased demand for accurate and reliable material modelling. As soft robots experience high deformations, highly nonlinear behavior is possible. Several analytical models that are able to capture this nonlinear behavior have been proposed, however, accurately calibrating them for specific materials and applications can be challenging. Multiple experimental testbeds may be required for material characterization which can be expensive and cumbersome. In this work, we propose an alternative framework for parameter fitting established hyperelastic material models, with the aim of improving their utility in the modelling of soft continuum robots. We define a minimization problem to reduce fitting errors between a soft continuum robot deformed experimentally and its equivalent finite element simulation. The soft material is characterized using four commonly employed hyperelastic material models (Neo Hookean; Mooney-Rivlin; Yeoh; and Ogden). To meet the complexity of the defined problem, we use an evolutionary algorithm to navigate the search space and determine optimal parameters for a selected material model and a specific actuation method, naming this approach as Evolutionary Inverse Material Identification (EIMI). We test the proposed approach with a magnetically actuated soft robot by characterizing two polymers often employed in the field: Dragon Skin™ 10 MEDIUM and Ecoflex™ 00-50. To determine the goodness of the FEM simulation for a specific set of model parameters, we define a function that measures the distance between the mesh of the FEM simulation and the experimental data. Our characterization framework showed an improvement greater than 6% compared to conventional model fitting approaches at different strain ranges based on the benchmark defined. Furthermore, the low variability across the different models obtained using our approach demonstrates reduced dependence on model and strain-range selection, making it well suited to application-specific soft robot modelling.

Dataset Information

Inverse design of soft materials via a deep learning-based evolutionary strategy.

Publications

Inverse design of soft materials via a deep learning-based evolutionary strategy.

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