def test_atomic_h5_readin():
    data = atomic.read_basic_atom_data(atomic.default_atom_h5_path)
    assert data['atomic_number'][13] == 14
    assert data['symbol'][13] == "Si"
    si_mass = data['mass'][13]
    testing.assert_almost_equal(si_mass, 28.085, decimal=4)
    pass
Esempio n. 2
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def test_atomic_h5_readin():
    data = atomic.read_basic_atom_data(atomic.default_atom_h5_path)
    assert data['atomic_number'][13] == 14
    assert data['symbol'][13] == "Si"
    si_mass = data['mass'][13]
    testing.assert_almost_equal(si_mass, 28.085, decimal=4)
    pass
Esempio n. 3
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def test_atomic_h5_readin():
    data = atomic.read_basic_atom_data()
    assert data['atomic_number'][13] == 14
    assert data['symbol'][13] == "Si"
    si_mass = units.Unit('g').to('u', data['mass'][13])
    testing.assert_almost_equal(si_mass, 28.085, decimal=4)
    pass
Esempio n. 4
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def test_read_basic_atom_data(default_atom_h5_path):
    data = atomic.read_basic_atom_data(default_atom_h5_path)
    assert data['atomic_number'][13] == 14
    assert data['symbol'][13] == "Si"
    testing.assert_almost_equal(data['mass'][13], 28.085, decimal=4)