PTEROSOR/QuantumPackage
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2 Commits

Author SHA1 Message Date
Anthony Scemama
1b9a75f488 Fixed pseudo-inverse (extrapolations) 2024-02-12 18:19:05 +01:00
ydamour
b16a6c7d53 add molecular properties 2023-03-11 22:31:57 +01:00