bond/react: remember reaction counts

allow restart files to restore cumutative reaction counts
This commit is contained in:
jrgissing
2019-09-01 23:31:31 -06:00
parent 86c21264b9
commit 50af20d194
3 changed files with 56 additions and 4 deletions

View File

@ -392,10 +392,11 @@ local command.
[Restart, fix_modify, output, run start/stop, minimize info:]
No information about this fix is written to "binary restart
files"_restart.html, aside from internally-created per-atom
properties. None of the "fix_modify"_fix_modify.html options are
relevant to this fix.
Cumulative reaction counts for each reaction are written to "binary
restart files"_restart.html. These values are associated with the
reaction name (react-ID). Additionally, internally-created per-atom
properties are stored to allow for smooth restarts. None of the
"fix_modify"_fix_modify.html options are relevant to this fix.
This fix computes one statistic for each {react} argument that it
stores in a global vector, of length 'number of react arguments', that