Clarifying break no alternate

This commit is contained in:
jtclemm
2024-12-09 11:14:29 -07:00
parent 2562d3afc4
commit fdfe6d54c6
2 changed files with 6 additions and 4 deletions

View File

@ -156,8 +156,9 @@ If the *break* keyword is set to *no*, LAMMPS assumes bonds should not break
during a simulation run. This will prevent some unnecessary calculation. during a simulation run. This will prevent some unnecessary calculation.
The recommended bond communication distance no longer depends on bond failure The recommended bond communication distance no longer depends on bond failure
coefficients (which are ignored) but instead corresponds to the typical heurestic coefficients (which are ignored) but instead corresponds to the typical heurestic
maximum strain used by typical non-bpm bond styles. One cannot use *break no* maximum strain used by typical non-bpm bond styles. Similar behavior to *break no*
with *smooth yes*. can also be attained by setting arbitrarily high values for all four failure
coefficients. One cannot use *break no* with *smooth yes*.
If the *store/local* keyword is used, an internal fix will track bonds that If the *store/local* keyword is used, an internal fix will track bonds that
break during the simulation. Whenever a bond breaks, data is processed break during the simulation. Whenever a bond breaks, data is processed

View File

@ -119,8 +119,9 @@ If the *break* keyword is set to *no*, LAMMPS assumes bonds should not break
during a simulation run. This will prevent some unnecessary calculation. during a simulation run. This will prevent some unnecessary calculation.
The recommended bond communication distance no longer depends on the value of The recommended bond communication distance no longer depends on the value of
:math:`\epsilon_c` (which is ignored) but instead corresponds to the typical :math:`\epsilon_c` (which is ignored) but instead corresponds to the typical
heurestic maximum strain used by typical non-bpm bond styles. One cannot use heurestic maximum strain used by typical non-bpm bond styles. Similar behavior
*break no* with *smooth yes*. to *break no* can also be attained by setting an arbitrarily high value of
:math:`\epsilon_c`. One cannot use *break no* with *smooth yes*.
.. versionadded:: TBD .. versionadded:: TBD