About the job
CuspAI is an AI-driven company focused on advancing material science. The team brings together recognized leaders in AI, chemistry, and engineering to address challenges in fields such as energy, clean water, computing, and carbon capture. Their work centers on developing a 'search engine' for next-generation materials, aiming to speed up material discovery and deliver real-world impact.
As a Scientific Software Engineer specializing in Polymer Simulations, the role centers on building and refining atomistic simulation capabilities for polymer systems. The official title will be 'Member of Technical Staff', reflecting the technical depth of the position.
Role overview
This position focuses on designing workflows, setting methodologies, and establishing standards for polymer simulations. The work connects atomic-level modeling with the broader material properties that matter in industrial applications. Collaboration with both AI researchers and experimental partners is a key part of the job.
What you will do
- Design and implement atomistic simulation workflows for polymer systems, including polymerization, melt equilibration, and production runs.
- Introduce and explore simulation techniques beyond molecular dynamics to address complex material challenges.
- Work with the AI research team to integrate machine learning models into simulation workflows, linking computational, experimental, and AI-driven insights.
- Collaborate with experimental partners to validate simulation results and strengthen the feedback loop between simulation and experiment.

