Hi,
I am getting the following problem :
"ERROR: Per-atom energy was not tallied on needed timestep"
How to get rid of this ?
Regards.
Prithwish
Hi,
I am getting the following problem :
"ERROR: Per-atom energy was not tallied on needed timestep"
How to get rid of this ?
Regards.
Prithwish
Post your input script. It seems like you are using a fix which is not invoked at that particular timestep, where you are calculating the energy,