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PaNOSC-ViNYL / ViNYL-project

This repository keeps track of tasks, milestones, deliverables of workpackage 5 in panosc.
Apache License 2.0
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DFT target calculator #36

Open CFGrote opened 4 years ago

CFGrote commented 4 years ago

Develop a DFT target (sample) calculator based on ASE and Mousumi's demo notebook