Merge pull request #101 from dptech-corp/change-rcond

change the default value of `rcond` from `1e-3` to `None`
dptech-corp · Jul 20, 2023 · 0e2cb9c · 0e2cb9c
2 parents 51d9ed5 + 6e30b51
commit 0e2cb9c
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/deepmd_pt/utils/stat.py b/deepmd_pt/utils/stat.py
@@ -83,7 +83,7 @@ def make_stat_input(datasets, dataloaders, nbatches):
     return lst
 
 
-def compute_output_stats(energy, natoms, rcond=1e-3):
+def compute_output_stats(energy, natoms, rcond=None):
     """Update mean and stddev for descriptor elements.
 
     Args: