Qi (Ryan) Zhang
Ph.D. student in Materials Science at Columbia University in the City of New York
Session
07-27
19:30
30min
Building workflows for materials modeling on HPC Systems
Qi (Ryan) Zhang
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.
JuliaCon
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