diff --git a/examples/QUANTUM/NWChem/data.water.nwchem b/examples/QUANTUM/NWChem/data.water.nwchem.qmmm similarity index 100% rename from examples/QUANTUM/NWChem/data.water.nwchem rename to examples/QUANTUM/NWChem/data.water.nwchem.qmmm diff --git a/examples/QUANTUM/NWChem/in.water.nwchem.qmmm b/examples/QUANTUM/NWChem/in.water.nwchem.qmmm index 4b44002f58..d46a8e7498 100644 --- a/examples/QUANTUM/NWChem/in.water.nwchem.qmmm +++ b/examples/QUANTUM/NWChem/in.water.nwchem.qmmm @@ -6,7 +6,7 @@ atom_style full bond_style harmonic angle_style harmonic -read_data data.water.nwchem +read_data data.water.nwchem.qmmm # QM atoms are 1st water # MM atoms are 2nd water diff --git a/examples/QUANTUM/NWChem/in.water.nwchem.qmmm.plugin b/examples/QUANTUM/NWChem/in.water.nwchem.qmmm.plugin index 4460a04dc8..f79411e4d5 100644 --- a/examples/QUANTUM/NWChem/in.water.nwchem.qmmm.plugin +++ b/examples/QUANTUM/NWChem/in.water.nwchem.qmmm.plugin @@ -6,7 +6,7 @@ atom_style full bond_style harmonic angle_style harmonic -read_data data.water.nwchem +read_data data.water.nwchem.qmmm # QM atoms are 1st water # MM atoms are 2nd water