diff --git a/examples/PACKAGES/interlayer/ilp_tmds/MoS2.ILP b/examples/PACKAGES/interlayer/ilp_tmds/MoS2.ILP deleted file mode 120000 index 75dd894eef..0000000000 --- a/examples/PACKAGES/interlayer/ilp_tmds/MoS2.ILP +++ /dev/null @@ -1 +0,0 @@ -../../../../potentials/MoS2.ILP \ No newline at end of file diff --git a/examples/PACKAGES/interlayer/ilp_tmds/TMD.ILP b/examples/PACKAGES/interlayer/ilp_tmds/TMD.ILP new file mode 120000 index 0000000000..70f7ea18df --- /dev/null +++ b/examples/PACKAGES/interlayer/ilp_tmds/TMD.ILP @@ -0,0 +1 @@ +../../../../potentials/TMD.ILP \ No newline at end of file diff --git a/examples/PACKAGES/interlayer/ilp_tmds/in.mos2 b/examples/PACKAGES/interlayer/ilp_tmds/in.mos2 index b77f2fe719..0db4ec12d5 100644 --- a/examples/PACKAGES/interlayer/ilp_tmds/in.mos2 +++ b/examples/PACKAGES/interlayer/ilp_tmds/in.mos2 @@ -12,7 +12,7 @@ mass 4 95.94 pair_style hybrid/overlay sw/mod sw/mod ilp/tmd 16.0 pair_coeff * * sw/mod 1 tmd.sw.mod Mo S S NULL NULL NULL pair_coeff * * sw/mod 2 tmd.sw.mod NULL NULL NULL Mo S S -pair_coeff * * ilp/tmd MoS2.ILP Mo S S Mo S S +pair_coeff * * ilp/tmd TMD.ILP Mo S S Mo S S # Calculate the pair potential compute 0 all pair ilp/tmd