phono3py/test/cui/test_phono3py_load.py

19 lines
467 B
Python

"""Tests of Phono3py load."""
from __future__ import annotations
from phono3py import Phono3py
def test_phono3py_load(si_pbesol_without_forcesets: Phono3py):
"""Test phono3py.load.
Check phono3py.load can read displacements from phono3py_disp.yaml like file
that doesn't contain forces.
"""
ph3 = si_pbesol_without_forcesets
assert ph3.dataset is not None
assert ph3.displacements.shape == (111, 64, 3)
assert ph3.forces is None