Hi,
I faced the same problem too, even when I used Material Studio to convert the original .cif file to P1 symmetry.
I have one query, is it necessary to always convert the input structure to P1 symmetry for RASPA or we can also provide the original symmetry?
Thanks in advance!
Warm regards,
Somananda
I faced the same problem too, even when I used Material Studio to convert the original .cif file to P1 symmetry.
I have one query, is it necessary to always convert the input structure to P1 symmetry for RASPA or we can also provide the original symmetry?
Thanks in advance!
Warm regards,
Somananda