File name: Pandora75s1_EssexMD_20260121_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20260122T052806.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20260121_L1_smca1c3d20230525p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20260121 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 session 2 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0305 305.1717 305.3128 305.4540 305.5951 305.7363 305.8774 306.0185 306.1596 306.3007 306.4418 306.5828 306.7239 306.8649 307.0060 307.1470 307.2880 307.4290 307.5700 307.7110 307.8519 307.9929 308.1338 308.2747 308.4157 308.5566 308.6975 308.8384 308.9792 309.1201 309.2610 309.4018 309.5426 309.6834 309.8243 309.9651 310.1058 310.2466 310.3874 310.5281 310.6689 310.8096 310.9503 311.0910 311.2317 311.3724 311.5131 311.6537 311.7944 311.9350 312.0757 312.2163 312.3569 312.4975 312.6381 312.7786 312.9192 313.0598 313.2003 313.3408 313.4813 313.6218 313.7623 313.9028 314.0433 314.1838 314.3242 314.4646 314.6051 314.7455 314.8859 315.0263 315.1667 315.3070 315.4474 315.5877 315.7281 315.8684 316.0087 316.1490 316.2893 316.4296 316.5699 316.7101 316.8504 316.9906 317.1308 317.2710 317.4112 317.5514 317.6916 317.8318 317.9719 318.1121 318.2522 318.3923 318.5324 318.6725 318.8126 318.9527 319.0927 319.2328 319.3728 319.5129 319.6529 319.7929 319.9329 320.0729 320.2128 320.3528 320.4927 320.6327 320.7726 320.9125 321.0524 321.1923 321.3322 321.4721 321.6119 321.7518 321.8916 322.0314 322.1712 322.3110 322.4508 322.5906 322.7304 322.8701 323.0099 323.1496 323.2893 323.4290 323.5687 323.7084 323.8481 323.9877 324.1274 324.2670 324.4067 324.5463 324.6859 324.8255 324.9650 --------------------------------------------------------------------------------------- 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 20260121T130502.0Z 9517.545162 62 1 23.62 2 83.39 122.42 101.42 95.38 0.00 1 0.00 1 0 25 7.495e-01 3.111e-02 3.428e-01 1.446e-02 9.331760e-01 8.520244e-03 1.096171e-02 -6.000000e+00 4.510348e-01 224.12 -2.00 3.48 -2.00 322.22 0.00e+00 2.241618e-02 4.682613e-03 1.497468e-03 -6.000000e+00 2.132415e-02 276.63 -2.00 20.00 -2.00 321.79 0.00e+00 7.907 0.009 302.00 328.00 3 1.0412e+00 3.1648e-02 9.5748e-02 -6.0000e+00 1.1170e+00 1.5061e+00 3.7608e-02 6.7091e-02 -6.0000e+00 1.2241e+00 -2.0395e+00 2.5699e-02 2.4588e-02 -6.0000e+00 7.2038e-01 8.2557e-01 1.2910e-02 2.2012e-02 -6.0000e+00 2.9782e-01 2.5451e-05 -4.2565e-04 4.1507e-04 4.0333e-04 -6.0000e+00 2.4007e-02 2.0869e-02 -5.2466e-05 12 9 9 12 1 1 11.42 22.76 1.19 0.02087 0.01767 15 6 1 5 0 1476.140 25.68 20.00 22.76 -0.81 7.4 827.50 -73691 147147 900000 900000 -4376 60966 900000 10084 -77357 114209 -24542 900000 24154 900000 304395 33552 64410 46115 54375 16930 900000 900000 58060 19717 -12098 155917 5821 51522 -28445 900000 24994 98792 900000 -22450 900000 94343 101157 12388 388163 91883 6161 403767 156966 111578 59640 177240 57322 114410 43036 142508 81576 78440 74475 900000 97669 87770 29052 1855 17850 2561 37188 32534 20102 33040 21102 32757 35538 31680 40807 32968 3409 48080 22483 -6096 6556 3471 11469 42303 -1395 -18796 54 -8584 7992 3500 -6513 2765 3230 2420 -2328 4847 4799 -4209 -5115 -7366 -6003 -5896 818 -3410 1269 -3054 -1753 -1768 -3218 -5133 -4283 -4563 -2579 -498 -2356 -1193 1776 458 -756 -2455 -3164 2884 -2111 581 -1334 1663 3403 2579 4270 -1300 2755 -552 836 3329 2070 2815 -980 694 -1583 492 108 539 283 1324 -1988 1427 -129 -858 -3112 -9504 2243 900000 900000 -224 1326 900000 271 -4452 1607 -722 900000 618 900000 4283 1502 2307 2064 2225 953 900000 900000 1559 706 -542 2194 186 988 -1237 900000 895 2022 900000 -1723 900000 1931 1941 618 5461 2468 410 5681 2650 2983 2685 2494 2742 3219 2604 3408 3902 4194 4401 900000 4809 4693 2698 214 1658 270 2878 2929 2347 3812 2910 4056 4350 4234 5454 5288 782 7103 4081 -1338 1125 552 1630 4761 -287 -5580 16 -3116 2687 1305 -2831 1148 1381 1059 -1054 1957 1823 -1676 -2080 -3358 -3167 -3741 580 -2922 1127 -2574 -1499 -1358 -2295 -3705 -3224 -3659 -2188 -459 -2300 -1333 2181 614 -1056 -3450 -4370 3718 -2942 829 -2031 2485 4849 3533 5532 -1724 3411 -694 1056 4535 3328 5192 -2107 1470 -3691 1206 284 1459 782 3621 -5479 3576 -303 -1902 -6925 SS 20260121T131546.6Z 9517.552623 65 1 51.40 2 81.66 124.27 99.39 96.96 0.00 1 0.00 1 0 25 5.354e-01 1.942e-02 1.115e-01 2.993e-03 8.280366e-01 1.647269e-03 1.008299e-02 -6.000000e+00 3.151460e-01 224.12 -2.00 3.48 -2.00 321.70 0.00e+00 1.236699e-02 8.845015e-04 6.400466e-03 -6.000000e+00 1.385514e-02 276.63 -2.00 20.00 -2.00 321.22 0.00e+00 6.481 0.005 302.00 328.00 3 8.4729e-01 5.7812e-03 8.0007e-02 -6.0000e+00 7.7694e-01 5.3873e-01 8.0192e-03 4.8208e-02 -6.0000e+00 8.4695e-01 -7.6864e-01 8.0471e-03 3.2280e-02 -6.0000e+00 5.0454e-01 3.1317e-01 3.7325e-03 1.6014e-02 -6.0000e+00 2.0953e-01 1.5628e-04 -5.5795e-04 8.3574e-05 3.2851e-04 -6.0000e+00 1.6557e-02 2.0544e-02 -5.4874e-05 12 9 8 11 8 0 1.74 22.76 0.78 0.02054 0.01635 120 20 1 5 0 428.300 25.68 20.00 22.76 1.12 7.6 843.46 -275977 -143222 -19164 -118656 -142692 -166184 -120273 -182361 -198944 -176059 -106107 -145066 -121371 -98324 -75415 -61233 -55425 -46454 -34556 -56609 36285 -15898 -45491 -28697 -57396 -41273 -70233 -62390 -18167 -3031 -6957 -31055 33835 -14119 17969 905 19488 -18058 34704 28091 16227 41592 26222 22731 20438 32252 21357 13031 22536 37601 21180 21525 23734 30322 24132 21258 14828 11175 7364 7418 11768 9493 10453 13153 13130 12855 9549 5917 10669 10215 7114 10983 3766 425 -1189 -2240 260 -1541 -4097 -3285 -1695 -890 -1188 -707 -999 808 975 1999 97 97 -33 -1852 -2713 -4627 -3444 -1241 -226 -787 421 -1265 -2018 -2919 -2340 -2068 -2714 -2607 -1413 -1074 201 650 955 -243 -647 -907 -1377 -788 -617 383 1100 867 2217 1998 2582 898 918 -145 753 1004 778 382 -242 82 -209 1 -190 83 519 721 -84 484 -453 -1090 -1755 -11569 -1862 -76 -1228 -1704 -2337 -1053 -3048 -4064 -2943 -929 -2194 -1900 -1644 -1301 -1121 -1103 -937 -660 -1382 381 -274 -1049 -570 -1541 -952 -2152 -1748 -339 -56 -164 -1142 750 -536 482 29 546 -843 1124 1123 810 1724 1332 1234 1163 1685 1296 909 1532 2403 1780 2010 2376 3062 2719 2525 1887 1445 959 957 1522 1402 1757 2430 2587 2574 2018 1373 2619 2841 2213 3379 1210 131 -337 -582 64 -408 -1291 -1236 -742 -442 -591 -374 -564 473 594 1230 60 58 -19 -1012 -1497 -2806 -2379 -994 -211 -776 443 -1349 -2030 -2922 -2151 -1894 -2637 -2683 -1541 -1173 244 895 1351 -370 -1006 -1386 -2043 -1142 -911 586 1749 1402 3455 2989 4006 1368 1352 -210 1091 1580 1297 728 -479 175 -478 2 -462 209 1328 1853 -213 1158 -1095 -2498 -3988 SS 20260121T133226.6Z 9517.564196 70 1 51.95 2 79.04 127.22 96.26 99.41 0.00 1 0.00 1 0 25 4.764e-01 1.116e-02 3.056e-02 1.116e-03 6.835451e-01 5.956571e-04 8.098768e-03 -6.000000e+00 2.804407e-01 224.12 -2.00 3.48 -2.00 320.71 0.00e+00 5.979897e-03 2.465314e-04 3.754571e-03 -6.000000e+00 1.232836e-02 276.63 -2.00 20.00 -2.00 320.18 0.00e+00 5.071 0.002 302.00 328.00 3 7.1417e-01 1.8322e-03 6.2417e-02 -6.0000e+00 6.9138e-01 1.3420e-01 2.3792e-03 3.8152e-02 -6.0000e+00 7.5365e-01 -1.7918e-01 2.3514e-03 2.3636e-02 -6.0000e+00 4.4897e-01 6.3262e-02 1.1561e-03 9.9359e-03 -6.0000e+00 1.8647e-01 8.1419e-04 -3.0548e-04 3.2146e-05 1.6309e-04 -6.0000e+00 1.4732e-02 1.9833e-02 -5.4733e-05 12 8 8 10 0 0 82.92 22.76 0.56 0.01983 0.01754 296 48 1 5 0 174.320 25.68 20.00 22.76 4.33 7.5 865.87 -221938 -164969 -135904 -146198 -162896 -157670 -121481 -151143 -145474 -133257 -123778 -108477 -94603 -84435 -65037 -52278 -47144 -27685 -29280 -28813 -20853 -30471 -29786 -26723 -28232 -22863 -34373 -30413 -34473 -23620 -16380 -15306 -5686 -9666 -8130 -10452 -5681 -9373 -441 1024 1508 3858 3042 2819 727 6145 3138 3520 3797 5745 4195 5806 6670 6237 5228 4045 2125 840 423 1360 2072 3308 4254 4891 4111 2622 1805 1608 2142 2961 1983 2254 1313 59 -1039 -2369 -3130 -3379 -2639 -2008 -1671 -1672 -1636 -1446 -582 122 761 1103 1029 534 240 -740 -1634 -1576 -1232 -400 351 559 372 -561 -1225 -1982 -1382 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