Closed 1477983539 closed 4 years ago
Hello!How can I get the same format as the 'structure' field in the examples datasets? I only have some POSCAR files.Can someone help me? BestWishes!
from pymatgen import Structure s = Structure.from_file("POSCAR")
Note - this is more a question for pymatgen, and help is through www.matsci.org
Thanks!
Hello!How can I get the same format as the 'structure' field in the examples datasets? I only have some POSCAR files.Can someone help me? BestWishes!