Merge pull request #1 from Lnaden/patch-1

Fix final exercise example
MolSSI-MDI · May 14, 2024 · c0ce5a9 · c0ce5a9
2 parents d78a2ee + 469fd18
commit c0ce5a9
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/driver_tutorial.md b/driver_tutorial.md
@@ -623,7 +623,7 @@ for i in range(nsteps):
 
     # Send the forces to LAMMPS
     mdi.MDI_Send_Command(">FORCES", lammps)
-    mdi.MDI_Send(ani_forces, lammps)
+    mdi.MDI_Send(ani_forces, 3 * natoms, mdi.MDI_DOUBLE, lammps)
 :::
     
 ```