diff --git a/examples/micelle/in.micelle b/examples/micelle/in.micelle index 128e4539ef..841e55ab2c 100644 --- a/examples/micelle/in.micelle +++ b/examples/micelle/in.micelle @@ -13,20 +13,25 @@ read_data data.micelle special_bonds fene pair_style soft 1.12246 -pair_coeff * * 1.0 20.0 1.12246 +pair_coeff * * 0.0 1.12246 bond_style harmonic bond_coeff 1 50.0 0.75 velocity all create 0.45 2349852 +variable prefactor equal 1.0+elapsed*(20.0-1.0)/1000 + fix 1 all nve fix 2 all temp/rescale 100 0.45 0.45 0.02 1.0 -fix 3 all enforce2d +fix 3 all adapt 1 pair soft a * * prefactor +fix 4 all enforce2d thermo 50 run 1000 +unfix 3 + # Main run pair_style lj/cut 2.5