diff --git a/doc/fix_wall.html b/doc/fix_wall.html index 82db4c5067..5e8f1546d9 100644 --- a/doc/fix_wall.html +++ b/doc/fix_wall.html @@ -47,7 +47,11 @@ box = the wall position is defined in simulation box units fld value = yes or no yes = invoke the wall constraint to be compatible with implicit FLD - yes = invoke the wall constraint in the normal way + no = invoke the wall constraint in the normal way + +
pbc value = yes or no + yes = allow periodic boundary in a wall dimension + no = require non-perioidic boundaries in any wall dimension@@ -173,6 +177,19 @@ to include the wall force in its calculations. If the setting is no, wall forces are imposed after pairwise interactions, in the usual manner. +
The pbc keyword can be used with a yes setting to allow walls to +be specified in a periodic dimension. See the +boundary command for options on simulation box +boundaries. The default for pbc is no, which means the system +must be non-periodic when using a wall. But you may wish to use a +periodic box. E.g. to allow some particles to interact with the wall +via the fix group-ID, and others to pass through it and wrap around a +periodic box. In this case you should insure that the wall if +sufficiently far enough away from the box boundary. If you do not, +then particles may interact with both the wall and with periodic +images on the other side of the box, which is probably not what you +want. +
Here are examples of variable definitions that move the wall position @@ -243,9 +260,7 @@ included in the total potential energy of the system (the quantity being minimized), you MUST enable the fix_modify energy option for this fix.
-Restrictions: -
-Any dimension (xyz) that has a wall must be non-periodic. +
Restrictions: none
Related commands:
@@ -255,6 +270,6 @@ being minimized), you MUST enable the fix_modifyDefault:
-The option defaults are no velocity, no wiggle, and units = lattice. +
The option defaults units = lattice, fld = no, and pbc = no.