bump lobsterpy==0.3.2 and fix TypeError: Analysis.__init__() got an u…

…nexpected keyword argument 'whichbonds'

pyproject.toml

@@ -42,7 +42,7 @@ amset = ["amset>=0.4.15", "pydash"]
 cclib = ["cclib"]
 mp = ["mp-api>=0.37.5"]
 phonons = ["phonopy>=1.10.8", "seekpath"]
-lobster = ["lobsterpy>=0.3.1"]
+lobster = ["lobsterpy>=0.3.2"]
 defects = ["dscribe>=1.2.0", "pymatgen-analysis-defects>=2022.11.30"]
 forcefields = ["chgnet>=0.2.2", "matgl>=0.8.3", "quippy-ase>=0.9.14"]
 docs = [
@@ -68,7 +68,7 @@ strict = [
     "dscribe==2.1.0",
     "emmet-core==0.70.0",
     "jobflow==0.1.14",
-    "lobsterpy==0.3.1",
+    "lobsterpy==0.3.2",
     "matgl==0.8.3",
     "monty==2023.9.25",
     "mp-api==0.37.5",

src/atomate2/lobster/schemas.py

@@ -229,7 +229,7 @@ def from_directory(
                 path_to_charge=charge_path,
                 summed_spins=False,  # we will always use spin polarization here
                 cutoff_icohp=0.10,
-                whichbonds=which_bonds,
+                which_bonds=which_bonds,
             )
             cba_run_time = time.time() - start
             # initialize lobsterpy condensed bonding analysis
@@ -262,7 +262,7 @@ def from_directory(
                 cohp_plot_data=cba_cohp_plot_data,
                 cutoff_icohp=analyse.cutoff_icohp,
                 summed_spins=False,
-                which_bonds=analyse.whichbonds,
+                which_bonds=analyse.which_bonds,
                 final_dict_bonds=analyse.final_dict_bonds,
                 final_dict_ions=analyse.final_dict_ions,
                 run_time=cba_run_time,
@@ -683,7 +683,7 @@ def _identify_strongest_bonds(
                     are_cobis=are_cobis,
                     are_coops=are_coops,
                     strongest_bonds=bond_dict,
-                    which_bonds=analyse.whichbonds,
+                    which_bonds=analyse.which_bonds,
                 )
             )
         else: