About the Role
LILA is seeking a leader to own the technical direction for agentic AI systems applied to materials science. This role involves setting and executing a roadmap for autonomous agents that plan, run, and interpret materials experiments, shifting research from human-paced to machine-paced iteration. It is a player-coach position responsible for leading a team, setting standards for scientific rigor and engineering quality, and partnering with diverse teams to implement agentic systems.
Responsibilities
- Define and execute the agentic AI roadmap for materials science, including agentic frameworks and retrieval-augmented generation for understanding multi-modal research data.
- Lead the design of agentic frameworks grounded in scientific understanding and the state of the art, and deliver end-to-end systems.
- Hire, mentor, and grow a small cross-functional team of scientists and engineers; set the bar for scientific rigor, code quality, and reproducibility.
- Partner with diverse teams at Lila to push the state of the art and deliver systems that integrate with experimental infrastructure.
- Track state-of-the-art in agentic AI, scientific ML, data extraction, and reasoning models; translate external advances into internal direction, and publish or present findings.
Requirements
- PhD in Computer Science, Machine Learning, Materials Science, Chemistry, Physics, or a related field.
- 5+ years of post-PhD research and applied ML experience.
- Track record of building and shipping agentic systems, ML pipelines, or autonomous research workflows that delivered measurable scientific or product impact.
- Deep expertise across modern ML, NLP, and reasoning: LLMs, agentic frameworks, tool use, planning, data extraction, and multi-modal data.
- Working knowledge of materials science, computational chemistry, or condensed-matter physics sufficient to ground agent behavior in real scientific constraints.
- Proficiency in Python and the ML software stack, with strong engineering habits around reproducibility, testing, and production deployment.
- Experience leading scientists and engineers: setting technical direction, hiring, mentoring, and developing team members.
- Clear written and verbal communication; able to translate between research, engineering, and program stakeholders.
Skills
- Agentic AI
- Materials Science
- Machine Learning
- Autonomous Agents
- Roadmap Execution
- Scientific Reasoning
- LLMs
- Agentic Frameworks
- Retrieval-Augmented Generation
- Multi-modal Data Understanding
- NLP
- Tool Use
- Planning
- Data Extraction
- Python
- ML Software Stack
- Reproducibility
- Testing
- Production Deployment
- Team Leadership
- Scientific Rigor
- Engineering Quality
- Cross-team Partnership
- Research Currency
- External Voice
- Scientific ML
- Reasoning Models
- Computational Chemistry
- Condensed-matter Physics
- Workflow Orchestration
- Distributed Compute
Location
- U.S.
Work Type
- Full-time
Experience Level
- 5+ years of post-PhD research and applied ML experience
- Experience leading scientists and engineers
Education Level
- PhD in Computer Science, Machine Learning, Materials Science, Chemistry, Physics, or a related field
Salary/Compensations
- $288,000—$420,000 USD
Benefits
- Competitive base compensation
- Bonus potential
- Generous early-stage equity
- Comprehensive benefits program including medical, dental, and vision coverage
- Employer-paid life and disability insurance
- Flexible time off with generous company wide holidays
- Paid parental leave
- Educational assistance program
- Commuter benefits, including bike share memberships for office based employees
- Company subsidized lunch program
- International benefits tailored to their region
About the Company
- Lila Sciences is building Scientific Superintelligence™ to solve humankind's greatest challenges.
- We believe science is the most inspiring frontier for AI.
- Rather than hard-coding expert knowledge into tools, LILA builds systems that can learn for themselves.
- LILA combines advanced AI models with proprietary AI Science Factory™ instruments into an operating system for science that executes the entire scientific method autonomously, accelerating discovery at unprecedented speed, scale, and impact across medicine, materials, and energy.
- Guided by our core values of truth, trust, curiosity, grit, and velocity, we move with startup speed while tackling problems of historic importance.
Equal Opportunity
- Lila Sciences is committed to equal employment opportunity regardless of race, color, ancestry, religion, sex, national origin, sexual orientation, age, citizenship, marital status, disability, gender identity or Veteran status.
