I am working on the different Energy and direction atomic cascade ,
for that 101010 super lattice system ,
for "
fix ID group-ID dt/reset N Tmin Tmax Xmax keyword values ...
"
how can i make a set can be time effective cost (less calculating time ),
if i say Tmin :Null
Tmax:0.002 ps
Xmax:0.01 A
N :10
Runs:6000 run
is that effective way to go ? , i went to the time evolution where i draw the P.E (potential energy ) Vs runing time or Number of runs where i tried to make it 6000 or 10000 or 20000 runs , with Xmax varies from 0.0001 to 1 A ,
but it was not even clear for me to decide the set which can be acceptable for any energy of direction
I may ask the question in another way , How can i achieve the dt/rest command set to suits all projection direction and energy i may choose ?,
Looking to hear from you soon
Thank you