Ph.D. student in Materials Science at Columbia University in the City of New York


19:30 UTC

Building workflows for materials modeling on HPC Systems

07/27/2022, 7:30 PM8:00 PM UTC

Materials computations, especially of the ab initio kind, are intrinsically complex. These difficulties have inspired us to develop an extensible, lightweight, high-level workflow framework, Express.jl, to automate long and extensive sequences of the ab initio calculations. In this talk, we would like to share some experiences that we gained in building a software framework and multifunctional scientific tools with Julia's versatility.

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Julia ComputingRelational AIJulius Technology

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Invenia LabsBeacon BiosignalsMetalenzASMLG-ResearchConningPumas AIQuEra Computing Inc.Jeffrey Sarnoff

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