예제 #1
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def test_oh1_charges():
    for scheme in iter_oh1_sto3g_gaussian_schemes():
        yield check_oh1_charges, scheme
예제 #2
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def test_oh1_charges():
    for scheme in iter_oh1_sto3g_gaussian_schemes():
        yield check_oh1_charges, scheme
예제 #3
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def test_oh1_bond_orders():
    for scheme in iter_oh1_sto3g_gaussian_schemes():
        yield check_oh1_bond_orders, scheme
예제 #4
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def test_oh1_bond_orders():
    for scheme in iter_oh1_sto3g_gaussian_schemes():
        yield check_oh1_bond_orders, scheme