AI Research Scientist - Machine Learning for Behavioral AI

Join Meta's Reality Labs Research to pioneer the application of generative AI in materials discovery for AR/VR devices and advanced robotic systems. Develop and deploy state-of-the-art models for molecular and crystal structure generation, property-conditioned design, and crystal structure prediction (CSP). Collaborate with computational chemists and AI agent scientists to close the loop from molecular design to experimental validation.

Requirements

• Develop, train, and deploy generative models for molecular and crystal structure generation, property-conditioned design, and CSP
• Design and implement reinforcement learning and alignment strategies to steer generative models toward physically stable and synthesizable candidates
• Collaborate closely with computational chemists to integrate first-principles calculations and molecular dynamics simulations into generative workflows
• Partner with AI agent scientists to embed generative molecular design capabilities into LLM-based multi-agent systems
• Curate, preprocess, and manage large-scale molecular and crystal structure datasets for model training and benchmarking

Benefits

• Generous Paid Time Off
• 401k Matching
• Retirement Plan
• Visa Sponsorship