Update batch_relaxation_example.rst

microsoft · Jan 7, 2025 · 73eb36b · 73eb36b
1 parent 8b2ee42
commit 73eb36b
Showing 1 changed file with 2 additions and 2 deletions.
diff --git a/docs/examples/batch_relaxation_example.rst b/docs/examples/batch_relaxation_example.rst
@@ -1,4 +1,4 @@
-Batch relaxation
+Batch Structure Optimization
 ================
 
 This is a simple example of how to use MatterSim to efficiently relax a list of structures.
@@ -62,4 +62,4 @@ Inspect the relaxed structures
 
     # verify by inspection that total energy has decreased in all instances
     for initial_energy, relaxed_energy in zip(initial_energies, relaxed_energies):
-        print(f"Initial energy: {initial_energy} eV, relaxed energy: {relaxed_energy} eV")
+        print(f"Initial energy: {initial_energy} eV, relaxed energy: {relaxed_energy} eV")