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Boron's atomic number is 5
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sgbaird committed Jun 28, 2022
1 parent 918a42c commit d705b7c
Showing 1 changed file with 1 addition and 1 deletion.
2 changes: 1 addition & 1 deletion tests/xtal2png_test.py
Original file line number Diff line number Diff line change
Expand Up @@ -292,7 +292,7 @@ def test_primitive_decoding():
def test_fit():
xc = XtalConverter(relax_on_decode=False)
xc.fit(example_structures + dummy_structures)
assert_array_equal((14, 82), xc._atom_range)
assert_array_equal((5, 82), xc._atom_range)
assert_allclose((3.84, 12.718448099999998), xc.a_range)
assert_allclose((3.395504, 11.292530369999998), xc.b_range)
assert_allclose((3.84, 10.6047314973), xc.c_range)
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