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About the potential energy

Status: Open.

#53 In AIRI-Institute/nablaDFT;

· lingcon01 opened on May 5, 2025

Customize the dataset

Status: Open.

#50 In AIRI-Institute/nablaDFT;

· Maximilian1794 opened on Feb 14, 2025

How the raw wfn files are organized

Status: Open.

#46 In AIRI-Institute/nablaDFT;

· MegaGatlingPea opened on Jan 28, 2025

Questions on the full set of forces

Status: Open.

#45 In AIRI-Institute/nablaDFT;

· cholin01 opened on Nov 20, 2024

improve download experience

Status: Open.

#28 In AIRI-Institute/nablaDFT;

· Fadelis98 opened on May 27, 2024

SchNOrb?

Status: Open.

#27 In AIRI-Institute/nablaDFT;

· karsar opened on May 27, 2024