Hi,
How can we store the first calculated value of a compute command (in a variable) to use it later in the simulation? (and to uncompute the compute command)
For example for the following variable:
compute Vol_1 1 voronoi/atom
compute Voll_1 1 reduce sum c_Vol_1[1]
variable Vol_1 equal c_Voll_1
I used the following two separately, and get errors for both.
variable Vol_1_0 equal ${Vol_1}
{ERROR: Substitution for illegal variable}