Loading doc/src/fix_rhok.txt +9 −13 Original line number Diff line number Diff line Loading @@ -18,7 +18,9 @@ a = anchor point of bias potential :ul [Examples:] fix bias all rhok 16 0 0 4.0 16.0 fix bias Bs rhok 12 12 0 10.0 24.0 :pre fix 1 all npt temp 0.8 0.8 4.0 z 2.2 2.2 8.0 # output U_bias rho_k_RE rho_k_IM |rho_k| thermo_style custom step temp pzz lz f_bias f_bias\[1\] f_bias\[2\] f_bias\[3\] :pre [Description:] Loading @@ -27,20 +29,14 @@ The fix applies an force to atoms given by the potential :c,image(Eqs/fix_rhok.jpg) as described in "(Pedersen)"_#Pedersen. The energy and the value of the collective density field can be written by including # output U_bias rho_k_RE rho_k_IM |rho_k| thermo_style custom step temp pzz pe lz f_bias f_bias\[1\] f_bias\[2\] f_bias\[3\] :pre to the input script. This field that bias long-range order can be used to study crystal-liquid interfaces, This field, that bias configurations with long-range order, can be used to study crystal-liquid interfaces and determine melting temperatures "(Pedersen)"_#Pedersen. The folder {examples/pinning} of the source code contains an example of using the interface pinning method on the Lennard-Jones system. An example of using the interface pinning method is located in the folder {examples/USER/pinning} of the source code to LAMMPS. [Restrictions:] Loading Loading
doc/src/fix_rhok.txt +9 −13 Original line number Diff line number Diff line Loading @@ -18,7 +18,9 @@ a = anchor point of bias potential :ul [Examples:] fix bias all rhok 16 0 0 4.0 16.0 fix bias Bs rhok 12 12 0 10.0 24.0 :pre fix 1 all npt temp 0.8 0.8 4.0 z 2.2 2.2 8.0 # output U_bias rho_k_RE rho_k_IM |rho_k| thermo_style custom step temp pzz lz f_bias f_bias\[1\] f_bias\[2\] f_bias\[3\] :pre [Description:] Loading @@ -27,20 +29,14 @@ The fix applies an force to atoms given by the potential :c,image(Eqs/fix_rhok.jpg) as described in "(Pedersen)"_#Pedersen. The energy and the value of the collective density field can be written by including # output U_bias rho_k_RE rho_k_IM |rho_k| thermo_style custom step temp pzz pe lz f_bias f_bias\[1\] f_bias\[2\] f_bias\[3\] :pre to the input script. This field that bias long-range order can be used to study crystal-liquid interfaces, This field, that bias configurations with long-range order, can be used to study crystal-liquid interfaces and determine melting temperatures "(Pedersen)"_#Pedersen. The folder {examples/pinning} of the source code contains an example of using the interface pinning method on the Lennard-Jones system. An example of using the interface pinning method is located in the folder {examples/USER/pinning} of the source code to LAMMPS. [Restrictions:] Loading
