You can not select more than 25 topics
Topics must start with a letter or number, can include dashes ('-') and can be up to 35 characters long.
526 B
526 B
Redefine Box Boundaries
-redef_box redef_dim {xlo xhi} {ylo yhi} {zlo zhi}
This option allows for the user to redefine box boundaries deleting atoms/elements outside of the new box boundaries. Elements are refined to atmoistics if they intersect the newly defined box boundaries.
The arguments are described below:
redef_dim - The dimensions to be redefined. Can be any permutation of x, y, z, xy, yz, xz, xyz. The order of the dimensions dictates the order that the new dimensions must be defined