pre-commit auto-fixes

pymatgen/analysis/diffusion/__init__.py

@@ -1,6 +1,7 @@
 """
 Package for diffusion analysis.
 """
+
 from __future__ import annotations
 
 __author__ = "Materials Virtual Lab"

pymatgen/analysis/diffusion/aimd/clustering.py

@@ -6,6 +6,7 @@
 adaption for periodic boundary conditions. This can be used, for example, to
 determine likely atomic positions from MD trajectories.
 """
+
 from __future__ import annotations
 
 import random

pymatgen/analysis/diffusion/aimd/pathway.py

@@ -2,8 +2,9 @@
 # Distributed under the terms of the BSD License.
 
 """
- Algorithms for diffusion pathway analysis
+Algorithms for diffusion pathway analysis
 """
+
 from __future__ import annotations
 
 import itertools

pymatgen/analysis/diffusion/aimd/rdf.py

@@ -4,6 +4,7 @@
 """
 RDF implementation.
 """
+
 from __future__ import annotations
 
 from collections import Counter

pymatgen/analysis/diffusion/aimd/van_hove.py

@@ -4,6 +4,7 @@
 """
 Van Hove analysis for correlations.
 """
+
 from __future__ import annotations
 
 import itertools

pymatgen/analysis/diffusion/analyzer.py

@@ -16,6 +16,7 @@
     Li10GeP2S12 Lithium Super Ionic Conductor Material. Chemistry of Materials,
     24(1), 15-17. doi:10.1021/cm203303y
 """
+
 from __future__ import annotations
 
 import multiprocessing

pymatgen/analysis/diffusion/neb/full_path_mapper.py

@@ -3,6 +3,7 @@
 """
 Migraiton Graph Analysis
 """
+
 from __future__ import annotations
 
 __author__ = "Jimmy Shen"

pymatgen/analysis/diffusion/neb/io.py

@@ -4,6 +4,7 @@
 """
 Generate input fields for NEB calculations.
 """
+
 from __future__ import annotations
 
 import copy

pymatgen/analysis/diffusion/neb/pathfinder.py

@@ -4,6 +4,7 @@
 """
 Algorithms for NEB migration path analysis.
 """
+
 from __future__ import annotations
 
 import itertools

pymatgen/analysis/diffusion/neb/periodic_dijkstra.py

@@ -3,6 +3,7 @@
 """
 Dijkstra's path search on a graph where the nodes are on a periodic graph
 """
+
 from __future__ import annotations
 
 __author__ = "Jimmy Shen"

pymatgen/analysis/diffusion/utils/edge_data_from_sc.py

@@ -4,6 +4,7 @@
 """
 Function to add edge data to MigrationGraph through 2 SC structures
 """
+
 from __future__ import annotations
 
 __author__ = "Haoming Li"

pymatgen/analysis/diffusion/utils/maggma.py

@@ -5,6 +5,7 @@
 cathode materials The functions are isolated from the rest of the package so
 that the rest of the package will not depend on Maggma
 """
+
 from __future__ import annotations
 
 __author__ = "Jimmy Shen"

pymatgen/analysis/diffusion/utils/parse_entries.py

@@ -4,6 +4,7 @@
 """
 Functions for combining many ComputedEntry objects into MigrationGraph objects.
 """
+
 from __future__ import annotations
 
 import logging

pymatgen/analysis/diffusion/utils/supercells.py

@@ -3,6 +3,7 @@
 """
 Functions for creating supercells for NEB calculations
 """
+
 from __future__ import annotations
 
 import logging

setup.py

@@ -1,4 +1,5 @@
 """Setup file for pymatgen.analysis.diffusion."""
+
 from __future__ import annotations
 
 import os