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softmaterialslab / nanoconfinement-md

This code allows users to simulate ions confined between material surfaces that are nanometers apart, and extract the associated ionic structure.
Apache License 2.0
5 stars 13 forks source link

updates with new ML surrogate #170

Closed kadupitiya closed 3 years ago

kadupitiya commented 3 years ago

@jadhao: NanoHUB needs one change.