MedeA® Software

Your Gateway to Computational Materials Science

MedeA® is a leading environment for atomistic and multiscale simulation of materials. It enables professional, day-to-day deployment of atomic- and nano-scale computations for materials engineering, optimization, and discovery.

Materials Cube DDD

An Integrated Solution

MedeA combines:

  • World-class simulation engines
  • Validated property prediction modules
  • Experimental data integration for combining computed and measured results
  • Machine-learning capabilities for data-driven insights and predictive modeling
  • Structure builders and analysis tools

All integrated in a flexible environment that supports:

  • Reusable, validated workflows
  • Customization of protocols
  • Integration of external workflows and custom code
MedeA Flowchart with Graph

Broad Applicability

MedeA supports virtually any material class:

  • Metals and alloys
  • Semiconductors and insulators
  • Organic solids and polymers
  • Molecular systems and nanostructures

Simulations cover crystalline and amorphous solids, fluid phases, interfaces, and phenomena across multiple length and time scales.

Design and Interpret Experiments

MedeA workflows guide experiment design, prescreening, and interpretation of results, especially when experiments are costly or challenging.

Focus on Science

MedeA enables researchers to concentrate on:

  • Materials screening
  • Design of experiments
  • Scientific analysis

All steps are integrated into reusable workflows, from model setup to data analysis and result sharing.

High-Throughput and JobServer

  • Flowchart-based workflows store complete compute protocols.
  • JobServer ensures reproducibility, sharing, and refinement over time.
  • High-throughput mode handles: - Large datasets - Parallel tasks - Descriptor-based data mining - Computational screening
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Multiscale Modeling

From electronic structure calculations to phase-field and microstructure evolution simulations, MedeA offers a comprehensive platform for multiscale modeling and property prediction.

Learn More

Explore the capabilities of the MedeA software:

Visit: www.materialsdesign.com

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[1]MedeA and Materials Design are registered trademarks of Materials Design, Inc.