Exemplo n.º 1
0
            vib_lvl_name = vib_lvl_name_hitran_class1

            df.loc[:, 'viblvl_l'] = vib_lvl_name(df['vl'])
            df.loc[:, 'viblvl_u'] = vib_lvl_name(df['vu'])
            df.loc[:, 'band'] = df['viblvl_l'] + '->' + df['viblvl_u']

        else:
            raise NotImplementedError(
                'Lvlformat not defined for {0}: {1}'.format(
                    molecule, lvlformat))

    else:
        raise NotImplementedError(
            'Vibrational bands not yet defined for molecule: ' +
            '{0} with database format: {1}. '.format(molecule, dbformat) +
            'Update add_bands()')

    if verbose:
        print(('... lines sorted in {0:.1f}s'.format(time() - t0)))

    return


# %% Test

if __name__ == '__main__':

    from radis.test.lbl.test_bands import run_testcases
    print('test_bands.py:', run_testcases(plot=True))
Exemplo n.º 2
0
            vib_lvl_name = vib_lvl_name_hitran_class1

            df.loc[:, "viblvl_l"] = vib_lvl_name(df["vl"])
            df.loc[:, "viblvl_u"] = vib_lvl_name(df["vu"])
            df.loc[:, "band"] = df["viblvl_l"] + "->" + df["viblvl_u"]

        else:
            raise NotImplementedError(
                "Lvlformat not defined for {0}: {1}".format(
                    molecule, lvlformat))

    else:
        raise NotImplementedError(
            "Vibrational bands not yet defined for molecule: " +
            "{0} with database format: {1}. ".format(molecule, dbformat) +
            "Update add_bands()")

    if verbose:
        print(("... lines sorted in {0:.1f}s".format(time() - t0)))

    return


# %% Test

if __name__ == "__main__":

    from radis.test.lbl.test_bands import run_testcases

    print("test_bands.py:", run_testcases(plot=True))