Location: Room M2 – Melati Jr 4011 (Level 4)
Abstract: Mat3ra.com offers a cloud-native digital platform to run large-scale HPC tasks with a particular focus on materials modeling. Our platform empowers researchers, scientists, and engineers by providing an intuitive web interface that simplifies complex HPC workflows while offering robust collaboration capabilities. Whether you prefer tried-and-tested command line access or programmable API integration, Mat3ra.com offers tailored solutions for materials science research and development across academia and industry. In this half-day workshop, we will showcase various advantages of the Mat3ra.com. Our focus will span from Density Functional Theory simulations to the application of machine learning in molecular dynamics. Participants will engage in extensive hands-on sessions. Additionally, we will highlight the scalability of our cloud infrastructure, enabling researchers to push the boundaries of what is possible in materials science research. Please join us to explore how Mat3ra.com can revolutionize your approach to materials science research and unlock new possibilities for innovation.
In this half-day workshop at the SupercomputingAsia 2025 conference, we will showcase the advantages of the Mat3ra.com platform over traditional HPC setups. Our focus will span from Density Functional Theory (DFT) simulations to the application of machine learning in molecular dynamics. Participants will engage in extensive hands-on tutorials to learn about various DFT methodologies, including bandstructure analysis, density of states calculations, spin-magnetism studies, spin-orbit coupling effects, phonon dispersion relationships, and advanced molecular dynamics simulations. Additionally, we will highlight the scalability of our cloud infrastructure, showcasing how it can accommodate task-intensive HPC workflows. Practical examples will illustrate the platform’s capacity to handle large datasets and complex computations efficiently, enabling researchers to push the boundaries of what is possible in materials science. Please join us to explore how Mat3ra.com can revolutionize your approach to materials science research and unlock new possibilities for innovation.
Important Notes:
- Participants must bring their laptop/computer.
- Participants need to purchase suitable ticket with access to the workshops and register for the conference at https://sca25.sc-asia.org
- For up-to-date information on the workshop, please also register at the workshop page at https://www.mat3ra.com/events-posts/sca-2025
Workshop URL:
- Main Workshop URL: https://www.mat3ra.com/events-posts/sca-2025
- YouTube tutorials: https://www.youtube.com/@Mat3ra/videos
- Company: https://www.mat3ra.com/
- Documentation: https://docs.mat3ra.com/
