n2v: Density-to-potential inversion suite

n2v is an open-source code that performs density-to-potential inversions in the context of Kohn-Sham DFT.

Take a look at our documentation to learn to use our code:

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Contents:

• Installation
• First Steps
• On the Grid
• Inverting A Density
• API Documentation
• Engines

Cite our work: coming soon

n2v is library written by Victor H. Chavez and Yuming Shi. Victor H. Chavez is supported by a fellowship from The Molecular Sciences Software Institute under NSF grant OAC-1547580.

Copyright 2022 Wasserman Group.