File name: Pandora147s1_SWDetroitMI_20231114_L2Fit_fout2c1d20210609p1-8.txt File generation date: 20231115T084649.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 147 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora147_OF_v4d20210429.txt Instrument calibration file used: Pandora147s1_CF_v1d20210609.txt Level 1 file used: Pandora147s1_SWDetroitMI_20231114_L1_smca1c1d20210609p1-8.txt Full location name: SW Detroit (SWHS) (AQS-26-163-0015) Short location name: SWDetroitMI Country of location: USA Location latitude [deg]: 42.3026 Location longitude [deg]: -83.1068 Location altitude [m]: 178 Local noon date: 20231114 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 235 377 Nominal wavelengths inside fitting window [nm]: 305.0003 305.1412 305.2821 305.4229 305.5638 305.7046 305.8454 305.9863 306.1271 306.2679 306.4086 306.5494 306.6902 306.8309 306.9716 307.1124 307.2531 307.3938 307.5345 307.6752 307.8158 307.9565 308.0971 308.2378 308.3784 308.5190 308.6596 308.8002 308.9408 309.0813 309.2219 309.3624 309.5029 309.6435 309.7840 309.9245 310.0649 310.2054 310.3459 310.4863 310.6268 310.7672 310.9076 311.0480 311.1884 311.3288 311.4692 311.6095 311.7499 311.8902 312.0305 312.1708 312.3111 312.4514 312.5917 312.7320 312.8722 313.0124 313.1527 313.2929 313.4331 313.5733 313.7135 313.8537 313.9938 314.1340 314.2741 314.4142 314.5543 314.6944 314.8345 314.9746 315.1147 315.2547 315.3948 315.5348 315.6748 315.8149 315.9549 316.0948 316.2348 316.3748 316.5147 316.6547 316.7946 316.9345 317.0744 317.2143 317.3542 317.4941 317.6339 317.7738 317.9136 318.0534 318.1932 318.3330 318.4728 318.6126 318.7524 318.8921 319.0319 319.1716 319.3113 319.4510 319.5907 319.7304 319.8701 320.0097 320.1494 320.2890 320.4287 320.5683 320.7079 320.8475 320.9870 321.1266 321.2662 321.4057 321.5452 321.6848 321.8243 321.9638 322.1033 322.2427 322.3822 322.5216 322.6611 322.8005 322.9399 323.0793 323.2187 323.3581 323.4975 323.6368 323.7762 323.9155 324.0548 324.1941 324.3334 324.4727 324.6120 324.7512 324.8905 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20231114T125700.4Z 8718.539588 56 1 48.75 2 85.03 120.26 99.60 115.62 0.00 1 0.00 1 0 25 5.829e-01 4.668e-02 5.122e-01 4.889e-02 9.683557e-01 2.866122e-02 1.129949e-02 -6.000000e+00 3.289764e-01 222.96 -2.00 3.54 -2.00 322.16 0.00e+00 -2.001211e-02 1.129693e-02 3.384776e-03 -6.000000e+00 1.489632e-02 278.51 -2.00 20.00 -2.00 321.67 0.00e+00 9.875 0.018 302.00 328.00 3 -4.7079e-01 9.5154e-02 1.1587e-01 -6.0000e+00 8.0892e-01 1.7393e+00 1.1447e-01 7.9959e-02 -6.0000e+00 8.7833e-01 -2.0045e+00 7.9460e-02 2.6711e-02 -6.0000e+00 5.2379e-01 7.2692e-01 4.2991e-02 2.0752e-02 -6.0000e+00 2.3064e-01 2.1192e-05 -1.6211e-03 1.2879e-03 2.5051e-04 -6.0000e+00 1.5690e-02 -4.4516e-02 7.6429e-05 12 8 8 10 0 0 -1.16 16.18 0.96 -0.04452 -0.05670 27 6 1 5 0 1805.370 22.29 15.00 16.18 10.22 29.7 883.74 900000 38233 312558 232583 211975 900000 -30247 -51623 18565 -58653 -67217 10026 -92028 -34028 900000 12188 -11146 82816 -21689 -3966 -34801 -33625 -25806 -2722 26447 186308 -3747 155543 900000 19347 42741 -18995 86681 10570 30597 -73576 66732 9571 26612 -1665 49129 102780 73409 50045 55492 37019 -18530 -13714 65656 900000 76248 -35334 9600 46282 22619 31417 51279 38091 -14392 242720 27737 -12828 8147 60808 45412 30447 28170 24852 22617 61648 -9686 62396 78581 29652 3782 -15551 13025 -38131 -28691 -9581 4824 8783 10034 -2691 -177 -12141 7279 -15064 10366 299 10961 6279 -6318 12625 3866 1045 11072 2585 1186 214 -12584 -5874 1396 -6747 -6147 546 -6422 -3398 -6958 3012 5566 -3534 2412 2938 1097 2239 2025 -21 -30 -1458 -2533 -46 3581 -2911 4507 -953 4540 3051 5323 -1850 542 -1672 -348 -1378 -3102 1459 1872 533 -597 1956 -436 -684 -1459 900000 1821 14890 11080 10098 900000 -1441 -3327 884 -5095 -6593 478 -11863 -2837 900000 762 -929 3945 -2002 -295 -3316 -2903 -1921 -170 1417 8875 -301 7410 900000 922 2036 -1301 4129 661 1652 -9420 3179 578 1606 -154 3433 4896 4430 3656 3525 2587 -2119 -1437 3128 900000 3632 -5365 1098 3969 2658 3592 5049 4355 -2651 11563 2731 -1833 1009 5021 4904 3965 3668 3394 3376 7048 -2584 8719 9484 5556 829 -3605 1986 -9204 -6652 -2130 1118 2315 3027 -1017 -69 -5668 2936 -7846 4214 131 4073 2273 -2488 4170 1535 501 5697 1699 858 170 -11278 -4850 945 -4478 -4119 369 -4916 -2687 -6254 2803 5922 -4440 3110 3884 1463 2854 2695 -28 -42 -2135 -3809 -70 4890 -4095 5755 -1253 5493 3702 6965 -3097 1037 -3455 -775 -3339 -8302 4034 5402 1581 -1809 5685 -1220 -1877 -3720 SS 20231114T130837.1Z 8718.547651 59 1 48.96 2 83.20 122.33 97.78 117.40 0.00 1 0.00 1 0 25 5.155e-01 1.892e-02 3.324e-01 1.028e-02 8.442617e-01 5.785580e-03 9.500882e-03 -6.000000e+00 2.898506e-01 222.96 -2.00 3.54 -2.00 322.08 0.00e+00 4.987115e-03 3.236215e-03 1.247567e-03 -6.000000e+00 1.270270e-02 278.51 -2.00 20.00 -2.00 321.67 0.00e+00 7.716 0.009 302.00 328.00 3 -3.4147e-01 2.2091e-02 8.8738e-02 -6.0000e+00 7.1399e-01 7.4513e-01 3.0286e-02 4.9208e-02 -6.0000e+00 7.7532e-01 -1.0748e+00 2.9237e-02 2.6269e-02 -6.0000e+00 4.6209e-01 4.4864e-01 1.3680e-02 9.9733e-03 -6.0000e+00 2.0259e-01 1.8169e-04 -1.6273e-03 2.7693e-04 1.2476e-04 -6.0000e+00 1.3540e-02 -4.4390e-02 6.6651e-05 12 8 8 10 0 0 73.69 16.18 0.33 -0.04439 -0.05662 100 23 1 5 0 489.490 22.29 15.00 16.18 10.92 29.7 890.39 900000 -154086 -60895 -159454 -109506 -135357 -147194 -182522 -179470 -124338 -2590 -121759 -56794 -13313 -46677 7797 9211 94851 2126 29138 10920 76279 -39019 291962 -49364 -3921 -67481 9372 -66131 26718 -47958 28402 -39269 45844 14346 60460 9577 7726 1181 32989 74149 8577 59522 21850 56972 -8823 40767 26535 34973 9071 20140 39450 33088 10015 25798 25259 21425 20575 12945 11861 9432 16360 15681 27105 15592 13380 8988 14229 6334 19007 16436 17182 13398 10053 756 2554 -5298 -1218 -3604 -1845 -301 756 -1658 -1128 4614 -2579 3915 1918 2818 465 1816 -2667 1130 -6418 -1901 -5247 -1957 -2689 117 -497 -1994 -975 -2815 -773 -2242 -3058 -4579 -2350 -2088 -754 -1677 -183 -828 370 -1087 453 -322 -567 -147 492 699 1615 1525 2337 1563 1519 1182 357 1726 -203 871 -33 498 467 871 -849 -86 -161 612 -313 -153 -641 -1469 900000 -4214 -722 -5087 -1896 -2591 -2952 -5324 -5398 -2267 -26 -2220 -621 -133 -766 92 126 951 37 438 197 765 -960 2927 -1440 -83 -2460 169 -2170 375 -1443 541 -1611 1011 446 1091 278 248 47 1158 2007 446 2148 1075 2171 -587 1839 1410 1788 579 1248 2265 2262 940 2234 2302 2090 2044 1345 1178 928 1551 1672 2990 2203 2037 1409 2140 1091 3257 3326 3743 3102 2318 176 519 -1038 -220 -710 -420 -82 242 -629 -467 1910 -1222 1841 961 1428 239 877 -1257 487 -2972 -913 -3051 -1313 -2147 96 -451 -1824 -892 -2317 -566 -1698 -2523 -4052 -2168 -2099 -847 -2019 -247 -1203 539 -1572 618 -470 -852 -212 750 1087 2627 2354 3453 2263 2134 1614 483 2513 -354 1732 -68 1094 1094 2184 -2326 -243 -463 1769 -899 -414 -1613 -3459 SS 20231114T131927.2Z 8718.555176 62 1 48.75 2 81.52 124.30 96.10 119.07 0.00 1 0.00 1 0 17 5.708e-01 1.176e-02 1.471e-01 3.921e-03 7.367223e-01 2.155228e-03 8.451184e-03 -6.000000e+00 3.209328e-01 222.96 -2.00 3.54 -2.00 321.65 0.00e+00 4.353176e-03 1.118235e-03 1.247737e-03 -6.000000e+00 1.406429e-02 278.50 -2.00 20.00 -2.00 321.22 0.00e+00 6.390 0.005 302.00 328.00 3 -3.6159e-01 7.7072e-03 7.3993e-02 -6.0000e+00 7.9055e-01 2.6241e-01 1.1151e-02 4.1635e-02 -6.0000e+00 8.5845e-01 -3.8025e-01 1.1794e-02 2.3663e-02 -6.0000e+00 5.1163e-01 1.5634e-01 5.5158e-03 8.7612e-03 -6.0000e+00 2.2433e-01 7.3291e-04 -1.4468e-03 1.0785e-04 1.0985e-04 -6.0000e+00 1.4991e-02 -4.4980e-02 5.6808e-05 12 8 8 10 0 0 7.28 16.18 0.34 -0.04498 -0.05585 217 50 1 5 0 224.640 22.29 14.99 16.18 11.74 29.8 897.69 900000 -197555 -170219 -212890 -166850 -199522 -94259 -193699 -195342 -174461 -181513 -88662 -147415 -120282 -119477 -71229 -83000 -40668 -60492 -38316 -72322 -18694 -83797 -20452 -59931 -41374 -48765 -12589 -48640 -49914 -53145 -20120 -12466 -14991 13479 -14535 11929 -9922 3872 2618 12377 4573 24759 9846 22927 5540 18513 4167 9660 11974 10188 13488 13639 12007 10550 13932 8493 10777 6209 6427 3119 9136 5091 10404 8022 10792 4184 5042 2798 6601 5049 5519 3253 2779 2199 1401 1401 -3199 -1393 -2208 215 -1969 653 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