For bonds and angles, a bonds/angles that have been broken by setting +their bond/angle type to 0 will not be included. Bonds/angles that +have been turned off (see the fix shake or +delete_bonds commands) by setting their bond/angle +type negative are written into the file. This is consistent with the +compute bond/local and compute +angle/local commands +
Note that as atoms migrate from processor to processor, there will be no consistent ordering of the entries within the local vector or array from one timestep to the next. The only consistency that is diff --git a/doc/compute_property_local.txt b/doc/compute_property_local.txt index ffc25d4e8a..4fd1d26b6d 100644 --- a/doc/compute_property_local.txt +++ b/doc/compute_property_local.txt @@ -74,6 +74,14 @@ extracting bond, angle, etc info. For bonds, info about an individual bond will only be included if both atoms in the bond are in the specified compute group. Likewise for angles, dihedrals, etc. +For bonds and angles, a bonds/angles that have been broken by setting +their bond/angle type to 0 will not be included. Bonds/angles that +have been turned off (see the "fix shake"_fix_shake.html or +"delete_bonds"_delete_bonds.html commands) by setting their bond/angle +type negative are written into the file. This is consistent with the +"compute bond/local"_compute_bond_local.html and "compute +angle/local"_compute_angle_local.html commands + Note that as atoms migrate from processor to processor, there will be no consistent ordering of the entries within the local vector or array from one timestep to the next. The only consistency that is