Crafting Tomorrow's Materials Today
Designing Materials at the Atomic Scale
Conduct relevant materials science simulations for property calculations, materials screening, or to generate invaluable data for your AI-driven materials science solutions, all without needing to be a specialist in molecular simulations or to have access to expensive software or infrastructure.
Discover new materials for your products and technology
Test vast arrays of chemical combinations effectively
Gain insights into chemical reactions and reactivity
1. Create and Select Materials
Start by easily creating, importing, editing, and viewing molecular systems interactively with the Materys 3D Molecular Builder
2. Configure and Run
Simply run your desired simulation with a single click, or explore and configure advanced options for more detailed control
3. Analyze Data
Analyze and visualize data to derive meaningful insights, speed-up your R&D decision making process and effectively communicate findings
4. Keep your Data Organized
Easily find and access all your data at any time. Your simulation data will be well-organized and readily searchable
Discover the Right Materials
Exceptional Capabilities & Tools
Semiconductors
Easily screen thousands of materials for semiconductor R&D through automated workflows
Predict conductivity, bandgap, crystal structure and more for semiconductor R&D
Energy Storage & Conversion
Explore vast chemical spaces efficiently using automated workflows
Predict essential properties for advancing battery, fuel cell, and solar cell technologies
Organic Electronics
Conduct fast screening to quickly find new advanced materials
Predict critical optoelectronic properties with streamlined workflows
Electrochemistry
Predict redox potentials and electron transfer kinetics to optimize materials performance
Predict electrode processes, guiding electrocatalyst design and enhancing energy storage solutions
Catalysis & Reactivity
Discover new catalysts and reactants efficiently thanks to high-throughput automated workflow
Explain the specifics of how chemicals react, what they choose to react with, and how precisely they do so
Plastics & Polymers
Simulate interactions of polymers with solvents to predict stability, permeability and more
Calculate electronic and optical properties
Metal Alloys & Ceramics
Predict important characteristics and properties of inorganic materials with precision
Screen thousands of chemical compositions and calculate essential physical and chemical properties
Spectroscopy & Microscopy
Simulate spectras like IR, UV and Raman to enhance interpretation and reveal molecular insights
Calculate STM images to predict surface structures and guide experiments
and more...
If you require a specific use case, contact us: we can help!
Simple, Flexible & Powerful
The Materys platform provides powerful digital solutions for the development of next-generation materials
Made for
Experimentalists
Leap into the future of materials
Simulation Specialists
Speed up your materials research
Developers
Expand your software capabilities
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