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Application-Specific Computational Materials Design via Multiscale Modeling and the Inductive Design Exploration

Brett D Ellis1, David L McDowell2,3

  • 11Mechanical Engineering Technology, University of Maine, 5711 Boardman Hall, Orono, ME 04469 USA.

Integrating Materials and Manufacturing Innovation
|January 25, 2020
PubMed
Summary
This summary is machine-generated.

This study introduces a systematic process for material development, linking process-structure-property-performance (PSPP) relations to accelerate innovation. It uses multiscale modeling and the Inductive Design Exploration Method (IDEM) to optimize material and structural designs under uncertainty.

Keywords:
Inductive design exploration method (IDEM)Multiscale modeling

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Area of Science:

  • Materials Science and Engineering
  • Computational Materials Design
  • Structural Engineering

Background:

  • Traditional material development is slow, costly, and relies heavily on intuition.
  • Existing methods struggle to efficiently explore the design space while meeting application demands.
  • Lack of systematic approaches hinders the rapid transition of materials from lab to market.

Purpose of the Study:

  • To establish a systematic process for linking process-structure-property-performance (PSPP) relationships.
  • To accelerate the material development lifecycle by optimizing the exploration of the material design space.
  • To demonstrate a method for designing materials and structures that meet specific performance requirements under uncertainty.

Main Methods:

  • Utilized hierarchical multiscale modeling (analytical and finite element) to establish bottom-up PSPP mappings.
  • Employed the Inductive Design Exploration Method (IDEM) for top-down decision support, accounting for uncertainty.
  • Integrated micro-, meso-, and macro-length scales across four hierarchical levels, considering seven design variables.

Main Results:

  • Successfully constructed and validated PSPP mappings for ultra-high-performance concrete and a blast-resistant structural panel.
  • Identified ranged sets of feasible design variable values using IDEM, robustly searching for optimal material and structural properties.
  • Demonstrated the ability to account for propagated uncertainty in the design process.

Conclusions:

  • The proposed systematic approach significantly accelerates material development by efficiently exploring the design space.
  • The integration of multiscale modeling and IDEM provides a robust framework for designing materials and structures with defined performance.
  • This methodology enables the optimization of designs for multiple objectives, such as minimizing mass and cost, while ensuring performance robustness.