diff --git a/examples/USER/phonon/dynamical_matrix_command/Silicon/SiCGe.tersoff b/examples/USER/phonon/dynamical_matrix_command/Silicon/SiCGe.tersoff new file mode 120000 index 0000000000..74f53c4e75 --- /dev/null +++ b/examples/USER/phonon/dynamical_matrix_command/Silicon/SiCGe.tersoff @@ -0,0 +1 @@ +../../../../../potentials/SiCGe.tersoff \ No newline at end of file diff --git a/examples/USER/phonon/dynamical_matrix_command/Silicon/ff-silicon.lmp b/examples/USER/phonon/dynamical_matrix_command/Silicon/ff-silicon.lmp index 5768408b61..d7ee38b175 100755 --- a/examples/USER/phonon/dynamical_matrix_command/Silicon/ff-silicon.lmp +++ b/examples/USER/phonon/dynamical_matrix_command/Silicon/ff-silicon.lmp @@ -16,4 +16,4 @@ mass ${Si} 28.08550 ########################### pair_style tersoff -pair_coeff * * ../../../../../potentials/SiCGe.tersoff Si(D) +pair_coeff * * SiCGe.tersoff Si(D) diff --git a/examples/USER/phonon/dynamical_matrix_command/python/SiCGe.tersoff b/examples/USER/phonon/dynamical_matrix_command/python/SiCGe.tersoff new file mode 120000 index 0000000000..74f53c4e75 --- /dev/null +++ b/examples/USER/phonon/dynamical_matrix_command/python/SiCGe.tersoff @@ -0,0 +1 @@ +../../../../../potentials/SiCGe.tersoff \ No newline at end of file diff --git a/examples/USER/phonon/dynamical_matrix_command/python/dynmat.py b/examples/USER/phonon/dynamical_matrix_command/python/dynmat.py index 33cc3419b3..b628a96121 100644 --- a/examples/USER/phonon/dynamical_matrix_command/python/dynmat.py +++ b/examples/USER/phonon/dynamical_matrix_command/python/dynmat.py @@ -9,8 +9,8 @@ import numpy as np """ LAMMPS VARIABLES """ # data files -infile = "../Silicon/silicon_input_file.lmp" -ff_file = "../Silicon/ff-silicon.lmp" +infile = "silicon_input_file.lmp" +ff_file = "ff-silicon.lmp" # full output useful for testing lmp = lammps() diff --git a/examples/USER/phonon/dynamical_matrix_command/python/ff-silicon.lmp b/examples/USER/phonon/dynamical_matrix_command/python/ff-silicon.lmp new file mode 120000 index 0000000000..8b025f7c2b --- /dev/null +++ b/examples/USER/phonon/dynamical_matrix_command/python/ff-silicon.lmp @@ -0,0 +1 @@ +../Silicon/ff-silicon.lmp \ No newline at end of file diff --git a/examples/USER/phonon/dynamical_matrix_command/python/silicon_input_file.lmp b/examples/USER/phonon/dynamical_matrix_command/python/silicon_input_file.lmp new file mode 120000 index 0000000000..fb12681042 --- /dev/null +++ b/examples/USER/phonon/dynamical_matrix_command/python/silicon_input_file.lmp @@ -0,0 +1 @@ +../Silicon/silicon_input_file.lmp \ No newline at end of file