Fix fields in VHFOpt struct due to the change in pyscf-2.7

pyscf · Oct 30, 2024 · 8d60b1c · 8d60b1c
1 parent c85a2d1
commit 8d60b1c
Showing 1 changed file with 2 additions and 2 deletions.
diff --git a/pyscf/lrdf/lrdf.py b/pyscf/lrdf/lrdf.py
@@ -245,10 +245,10 @@ def __init__(self, mol, intor=None, prescreen='CVHFnoscreen',
 
     @property
     def direct_scf_tol(self):
-        return np.exp(self._this.direct_scf_cutoff)
+        return np.exp(self._this.direct_scf_tol)
     @direct_scf_tol.setter
     def direct_scf_tol(self, v):
-        self._this.direct_scf_cutoff = np.log(v)
+        self._this.direct_scf_tol = np.log(v)
 
     def init_cvhf_direct(self, mol, intor=None, qcondname=None):
         nbas = mol.nbas