UT theoretical chemistry code forum

Thank you sir for the help with the scripts. The issue is now fixed.

Sir, has the issue with dist.pl script been fixed?

Thank you Sir!!

Sir, the two POSCAR files, ini and fin-POSCAR for the initial and final coordinates of the atoms have been attached below. I want to calculate the distance between Li1 with coordinates (0.38 0.08 1.09) present in ini-POSCAR to Li2 with coordinates (0.7 0.62 1.09) present in fin-POSCAR.

Dear All, I have a trigonal crystal structure, and I would like to find the activation energy of the migration of an atom in it. Using VESTA, I have made 2 POSCARS for the initial and final position of the atom, and I know the distance between them. However, when I am using dist.pl script to find th...