File name: Pandora85s1_NewOrleansLA-XULA_20240813_L2Fit_fout2c2d20230315p1-8.txt File generation date: 20240814T061228.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Morewell Gasseller Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 85 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora85_OF_v3d20231120.txt Instrument calibration file used: Pandora85s1_CF_v2d20240315.txt Level 1 file used: Pandora85s1_NewOrleansLA-XULA_20240813_L1_smca1c2d20230315p1-8.txt Full location name: Xavier University of Louisiana Short location name: NewOrleansLA-XULA Country of location: United States Location latitude [deg]: 29.9643 Location longitude [deg]: -90.1074 Location altitude [m]: 10 Local noon date: 20240813 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OOB session based on clearance session 1 First and last pixel inside fitting window: 196 339 Nominal wavelengths inside fitting window [nm]: 305.0087 305.1493 305.2899 305.4305 305.5710 305.7116 305.8522 305.9927 306.1332 306.2737 306.4143 306.5547 306.6952 306.8357 306.9762 307.1166 307.2571 307.3975 307.5379 307.6783 307.8187 307.9591 308.0994 308.2398 308.3801 308.5205 308.6608 308.8011 308.9414 309.0817 309.2220 309.3623 309.5025 309.6428 309.7830 309.9232 310.0634 310.2036 310.3438 310.4840 310.6242 310.7643 310.9045 311.0446 311.1847 311.3248 311.4649 311.6050 311.7451 311.8851 312.0252 312.1652 312.3053 312.4453 312.5853 312.7253 312.8653 313.0052 313.1452 313.2851 313.4251 313.5650 313.7049 313.8448 313.9847 314.1246 314.2644 314.4043 314.5442 314.6840 314.8238 314.9636 315.1034 315.2432 315.3830 315.5227 315.6625 315.8022 315.9420 316.0817 316.2214 316.3611 316.5008 316.6404 316.7801 316.9198 317.0594 317.1990 317.3386 317.4782 317.6178 317.7574 317.8970 318.0365 318.1761 318.3156 318.4551 318.5947 318.7342 318.8736 319.0131 319.1526 319.2920 319.4315 319.5709 319.7103 319.8497 319.9891 320.1285 320.2679 320.4073 320.5466 320.6859 320.8253 320.9646 321.1039 321.2432 321.3825 321.5217 321.6610 321.8002 321.9395 322.0787 322.2179 322.3571 322.4963 322.6355 322.7746 322.9138 323.0529 323.1921 323.3312 323.4703 323.6094 323.7485 323.8875 324.0266 324.1656 324.3047 324.4437 324.5827 324.7217 324.8607 324.9997 --------------------------------------------------------------------------------------- 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: 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 77: 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 78: 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 79: 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 80: 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 81: 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 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Temperature at electronics board [°C], 999=no temperature signal Column 94: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Humidity in head sensor [%], -9=no humidity signal Column 98: Pressure in head sensor [hPa], -9=no pressure signal Columns 99-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-386: 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 20240813T121100.9Z 8991.507650 51 1 55.45 2 81.64 78.13 173.96 333.63 0.00 1 0.00 1 0 25 9.166e-01 6.380e-02 2.579e-01 9.988e-03 7.496271e-01 5.745363e-03 7.887670e-03 -6.000000e+00 5.518970e-01 229.60 -2.00 3.24 -2.00 321.47 0.00e+00 7.938038e-03 2.996404e-03 1.009810e-03 -6.000000e+00 3.581627e-02 294.63 -2.00 20.00 -2.00 320.78 0.00e+00 6.452 0.003 302.00 328.00 3 2.6918e+00 2.1151e-02 7.5215e-02 -6.0000e+00 1.3659e+00 1.1464e+00 2.6162e-02 4.4074e-02 -6.0000e+00 1.4929e+00 -1.3969e+00 1.8845e-02 1.7880e-02 -6.0000e+00 8.9179e-01 5.3115e-01 9.5397e-03 1.2709e-02 -6.0000e+00 3.8308e-01 2.2194e-05 -1.0985e-03 2.8942e-04 1.2205e-04 -6.0000e+00 2.7337e-02 -2.4198e-02 12 8 8 10 0 0 21.18 27.30 1.58 -0.02420 -0.03245 15 2 1 5 0 3696.440 34.50 20.01 27.30 35.60 21.1 1016.26 900000 900000 900000 107419 -30958 900000 13861 900000 -74955 61254 309845 900000 900000 900000 210548 900000 4138 900000 900000 900000 900000 106185 376110 264789 21820 900000 900000 900000 900000 900000 -17038 900000 462472 16938 -44381 111431 52903 40779 78710 900000 253536 900000 900000 71133 14798 -32845 900000 87974 10344 212057 95602 900000 44722 -29042 216245 131863 46561 19289 66286 16381 42869 260504 20919 -31618 12981 120212 -27590 54964 42936 31377 115270 67241 -26414 21214 6486 -1395 -29983 8004 -14100 34696 8567 406 1970 -18856 16706 28458 -193 4404 14754 -8401 12735 6211 1215 -10192 11424 -23225 4482 4582 -3015 -6200 5208 -4694 787 2726 2780 -7957 -716 -1723 436 -1680 -3646 6837 8443 3579 -5029 663 -2914 -7105 -7300 -4200 6237 5425 6797 2734 -267 578 -9301 2892 -3481 2173 2381 2209 2085 4673 -2637 589 -2000 142 96 2213 1692 -4595 -2231 938 900000 900000 900000 2366 -2291 900000 501 900000 -6473 1349 3003 900000 900000 900000 2041 900000 335 900000 900000 900000 900000 2994 3646 2567 1307 900000 900000 900000 900000 900000 -1351 900000 4483 1403 -6609 3456 2872 2688 4043 900000 2949 900000 900000 5585 2008 -6425 900000 5628 1464 4111 6301 900000 5809 -7626 5659 8180 6815 3665 7517 2890 5651 4040 3934 -11370 3297 10603 -10296 8950 8198 7482 13407 13491 -12405 6498 2106 -435 -11102 1932 -4455 7802 2981 178 964 -11149 8015 12909 -111 2526 8523 -5486 7024 3389 657 -6076 5858 -17600 3022 3605 -2938 -6687 4924 -4541 644 2013 2102 -7208 -636 -1648 443 -1948 -4903 9230 10870 4854 -7202 855 -3789 -9866 -10714 -6338 8715 7471 9648 3909 -379 786 -13515 3652 -5043 3135 3891 3991 4044 9346 -5593 1297 -4725 334 230 5116 3730 -10070 -4477 1919 SS 20240813T122456.0Z 8991.517315 56 1 53.79 2 78.68 79.77 174.58 3.51 0.00 1 0.00 1 0 17 5.161e-01 1.764e-02 1.612e-01 2.583e-03 5.673494e-01 1.363927e-03 6.947846e-03 -6.000000e+00 2.991583e-01 229.60 -2.00 3.24 -2.00 320.36 0.00e+00 2.216290e-03 5.316293e-04 4.996878e-03 -6.000000e+00 1.479524e-02 294.63 -2.00 20.00 -2.00 319.54 0.00e+00 4.917 0.001 302.00 328.00 3 2.4461e+00 4.2821e-03 6.0845e-02 -6.0000e+00 7.4316e-01 -1.7124e-03 5.3824e-03 4.1783e-02 -6.0000e+00 8.0652e-01 -8.7868e-02 4.6909e-03 1.4979e-02 -6.0000e+00 4.8045e-01 2.3739e-02 2.3977e-03 4.6894e-03 -6.0000e+00 2.0556e-01 2.0198e-04 -4.4433e-04 7.2939e-05 6.2098e-05 -6.0000e+00 1.4311e-02 -2.6300e-02 12 8 8 10 0 0 6.01 27.41 0.78 -0.02630 -0.02964 60 7 1 5 0 896.360 34.50 20.01 27.41 36.64 21.3 1016.40 900000 187952 900000 -87688 -163916 900000 -123680 900000 -134439 -102225 -31653 900000 366131 228443 -20920 900000 -61683 20230 69430 90490 93296 -30877 5796 3947 -31201 18786 74522 64572 -880 48442 -28032 39157 -10513 -19479 -31698 -13036 -11322 -25396 -7752 3216 12751 22872 17659 -2786 -2377 -10347 -6974 8572 -2757 8706 5014 15676 761 -7692 11252 9202 2543 1824 1460 -968 2040 9518 792 -2704 2909 9058 -6331 3244 1224 2847 7493 5753 -2753 2833 164 -2641 -5161 -3260 -6016 -1372 -1846 -1748 -1682 -3759 223 1370 350 1327 2491 455 1656 392 -1076 -4106 -1524 -4591 -385 155 -270 -625 187 -1827 -2394 -1493 -604 -2197 -831 194 390 1106 1418 2953 2628 1345 -580 -501 -981 -1265 -666 290 1321 1012 1362 1224 400 -54 -2042 -924 -851 -275 -524 -168 -544 -148 -618 -286 -161 590 980 714 304 -665 -649 -177 900000 473 900000 -1103 -4125 900000 -2210 900000 -3417 -2109 -343 900000 921 575 -400 900000 -2515 402 926 1048 1103 -1282 169 126 -1547 605 1444 1381 -35 1170 -1623 1370 -704 -1618 -3039 -987 -875 -2582 -798 364 1543 2757 2386 -483 -418 -2005 -1336 1430 -531 1558 1003 3148 179 -2140 2801 2457 755 558 444 -294 603 2761 279 -1118 1251 3711 -2911 1346 540 1273 3668 3115 -1674 1596 89 -1347 -2437 -1562 -2796 -692 -1103 -1207 -1209 -2980 180 1179 302 1187 2259 419 1436 345 -899 -3413 -1288 -4179 -387 167 -330 -763 237 -2196 -2624 -1630 -680 -2537 -998 245 494 1520 2033 4547 4210 2152 -902 -733 -1393 -1835 -1012 465 2183 1664 2164 1892 600 -78 -2904 -1343 -1230 -443 -888 -292 -1003 -285 -1202 -595 -335 1244 2102 1530 628 -1381 -1283 -343 SS 20240813T123058.8Z 8991.521514 59 1 53.74 2 77.39 80.48 174.37 16.95 0.00 1 0.00 1 0 17 1.839e-01 1.392e-02 4.185e-02 1.707e-03 5.173938e-01 8.771983e-04 6.086871e-03 -6.000000e+00 1.056738e-01 229.60 -2.00 3.24 -2.00 319.88 0.00e+00 8.690155e-04 2.914129e-04 3.455514e-03 -6.000000e+00 4.968459e-03 294.63 -2.00 20.00 -2.00 319.00 0.00e+00 4.451 0.001 302.00 328.00 3 2.2070e+00 2.6180e-03 5.3259e-02 -6.0000e+00 2.6226e-01 -5.5953e-02 3.1858e-03 3.3389e-02 -6.0000e+00 2.8421e-01 -2.8761e-02 2.5789e-03 1.2908e-02 -6.0000e+00 1.7005e-01 2.2770e-03 1.3446e-03 4.0783e-03 -6.0000e+00 7.2515e-02 4.2600e-04 -3.0100e-04 4.7861e-05 4.0790e-05 -6.0000e+00 5.0046e-03 -2.7294e-02 12 8 8 10 0 0 16.50 27.47 0.51 -0.02729 -0.02956 96 11 1 5 0 559.770 34.50 20.01 27.47 37.08 21.3 1016.46 900000 16388 34934 -65607 -85422 900000 -86119 -25825 -87431 -73714 -48004 -11623 7484 1054 -22929 41363 -37823 1872 4483 16862 12512 -32821 -9594 5388 -16660 13783 12108 28179 -12790 770 -18657 11006 -2014 -7094 -15659 -14694 -12677 -14083 -8527 3415 4587 7082 6337 -2750 -489 -4025 7065 3165 -731 2027 2940 5713 1834 -2694 4787 4205 1735 1107 621 468 1512 3747 1032 1645 3090 3588 -3609 631 -531 2639 3802 3304 -571 1795 -704 -1617 -3869 -3847 -5188 -2183 -2669 -2033 -1824 -2973 -476 566 563 1296 2441 1492 1464 344 -1165 -2810 -1223 -2866 -1045 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