forked from lijiext/lammps
doc typo
This commit is contained in:
parent
a69bd0405a
commit
e44402326f
|
@ -339,7 +339,7 @@ calculated in the same manner as for example
|
|||
options for additional temperature averaging or velocity-biased
|
||||
temperature calculations. A uniform random number between 0 and 1 is
|
||||
generated using {seed}; if this number is less than the result of the
|
||||
Arrhenius equation above, the reaction is permitted occur.
|
||||
Arrhenius equation above, the reaction is permitted to occur.
|
||||
|
||||
Once a reaction site has been successfully identified, data structures
|
||||
within LAMMPS that store bond topology are updated to reflect the
|
||||
|
@ -416,7 +416,7 @@ will apply to all reactions.
|
|||
Computationally, each timestep this fix operates, it loops over
|
||||
neighbor lists (for bond-forming reactions) and computes distances
|
||||
between pairs of atoms in the list. It also communicates between
|
||||
neighboring processors to coordinate which bonds are created and/or
|
||||
neighboring processors to coordinate which bonds are created and/or
|
||||
removed. All of these operations increase the cost of a timestep. Thus
|
||||
you should be cautious about invoking this fix too frequently.
|
||||
|
||||
|
|
Loading…
Reference in New Issue