Loading examples/latte/in.latte.sucrose.min +3 −2 Original line number Diff line number Diff line Loading @@ -4,7 +4,6 @@ units metal atom_style full atom_modify sort 0 0.0 # turn off sorting of the coordinates #read_data data.water read_data data.sucrose_non_opt.lmp # replicate system if requested Loading Loading @@ -39,4 +38,6 @@ thermo_style custom step temp pe etotal thermo 1 min_style cg minimize 1.0e-9 1.0e-9 1000 1000 min_modify dmax 0.1 min_modify line quadratic minimize 1.0e-6 1.0e-6 10000 10000 Loading
examples/latte/in.latte.sucrose.min +3 −2 Original line number Diff line number Diff line Loading @@ -4,7 +4,6 @@ units metal atom_style full atom_modify sort 0 0.0 # turn off sorting of the coordinates #read_data data.water read_data data.sucrose_non_opt.lmp # replicate system if requested Loading Loading @@ -39,4 +38,6 @@ thermo_style custom step temp pe etotal thermo 1 min_style cg minimize 1.0e-9 1.0e-9 1000 1000 min_modify dmax 0.1 min_modify line quadratic minimize 1.0e-6 1.0e-6 10000 10000
