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Postdoctoral Researcher in AI Chemistry

L5

virtual vocationsDenver, COyesterday
Seeking a full-time Postdoctoral Researcher in AI Chemistry, the successful candidate will develop and utilize an agentic AI framework for automating the exploration of reaction energetics in the synthesis of PGM-free fuel cell catalysts, collaborating with an interdisciplinary team in a dynamic research environment.
Key responsibilities: Develop an agentic AI framework to automate the training of machine-learned interatomic potentials (MLIPs) and explore reaction spaces for Fe-N-C catalyst synthesis Collaborate with researchers to study the chemistry of graphitization and Fe incorporation into the N-C matrix using various synthetic precursors Process, analyze, and visualize simulation results to provide chemical insights and author technical papers on AI-automated MLIP studies
Required qualifications: Recent PhD graduate within the last three years Strong knowledge of AI automation and frameworks such as LangChain Experience in chemistry and materials science, particularly integrating ML/AI into workflows Proficiency in creating Python environments for AI/ML tasks Interest in developing materials science and chemistry software packages like LAMMPS or Q-chem
Apply now (opens in a new tab)
Apply now (opens in a new tab)

Level

SeniorL5

Location

Denver, CO

Occupation

Materials Scientists

Industry

Research and Development in the Physical, Engineering, and Life Sciences

Posted

yesterday

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