File name: Pandora21s1_Bremen_20220524_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T110538.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v1d20201116.txt Level 1 file used: Pandora21s1_Bremen_20220524_L1_smca1c1d20201116p1-8.txt Full location name: Bremen University Short location name: Bremen Country of location: Germany Location latitude [deg]: 53.0813 Location longitude [deg]: 8.8126 Location altitude [m]: 50 Local noon date: 20220524 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: 286 428 Nominal wavelengths inside fitting window [nm]: 305.0633 305.2039 305.3445 305.4851 305.6257 305.7662 305.9068 306.0473 306.1878 306.3283 306.4688 306.6093 306.7497 306.8902 307.0306 307.1711 307.3115 307.4519 307.5923 307.7326 307.8730 308.0134 308.1537 308.2940 308.4343 308.5747 308.7149 308.8552 308.9955 309.1357 309.2760 309.4162 309.5564 309.6966 309.8368 309.9770 310.1172 310.2573 310.3975 310.5376 310.6777 310.8178 310.9579 311.0980 311.2380 311.3781 311.5181 311.6582 311.7982 311.9382 312.0782 312.2182 312.3581 312.4981 312.6380 312.7779 312.9179 313.0578 313.1976 313.3375 313.4774 313.6172 313.7571 313.8969 314.0367 314.1765 314.3163 314.4561 314.5959 314.7356 314.8754 315.0151 315.1548 315.2945 315.4342 315.5739 315.7135 315.8532 315.9928 316.1325 316.2721 316.4117 316.5513 316.6908 316.8304 316.9700 317.1095 317.2490 317.3885 317.5280 317.6675 317.8070 317.9465 318.0859 318.2254 318.3648 318.5042 318.6436 318.7830 318.9224 319.0617 319.2011 319.3404 319.4798 319.6191 319.7584 319.8977 320.0369 320.1762 320.3155 320.4547 320.5939 320.7331 320.8723 321.0115 321.1507 321.2899 321.4290 321.5682 321.7073 321.8464 321.9855 322.1246 322.2637 322.4028 322.5418 322.6808 322.8199 322.9589 323.0979 323.2369 323.3759 323.5148 323.6538 323.7927 323.9317 324.0706 324.2095 324.3484 324.4872 324.6261 324.7650 324.9038 --------------------------------------------------------------------------------------- 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 20220524T071547.6Z 8179.302634 232 1 50.43 2 56.50 99.95 61.41 185.71 0.00 1 0.00 1 0 25 5.627e-02 1.201e-02 5.356e-02 1.042e-02 3.000919e-01 5.489888e-03 3.985508e-03 -6.000000e+00 3.406681e-02 231.80 -2.00 3.88 -2.00 318.38 0.00e+00 2.266872e-03 9.400059e-04 9.685116e-05 -6.000000e+00 1.347613e-03 277.23 -2.00 20.00 -2.00 318.06 0.00e+00 1.806 0.000 302.00 328.00 3 6.8036e+00 1.4769e-02 2.5359e-02 -6.0000e+00 8.6052e-02 6.6373e-02 1.6535e-02 1.7449e-02 -6.0000e+00 9.3187e-02 2.3090e-02 1.0989e-02 8.6466e-03 -6.0000e+00 5.4610e-02 -1.3520e-02 5.6544e-03 2.4705e-03 -6.0000e+00 2.2518e-02 6.2515e-05 -8.2726e-04 3.3030e-04 3.0972e-05 -6.0000e+00 1.6904e-03 -1.8048e-02 -7.3847e-05 12 8 8 10 0 0 99.98 22.25 0.36 -0.01805 -0.02426 44 9 1 5 0 1145.654 25.28 20.00 22.25 23.15 29.3 999.10 -3296 -618 -13235 26313 -17102 26770 -15422 -5474 -11631 15675 -3107 -6544 -651 -3821 17240 209 15436 4975 -5993 7564 6615 8852 -6282 3710 1150 4686 -6495 12298 -4758 -1388 5890 -1762 8945 -5335 14433 -4823 1447 -1422 -2297 -4422 -2578 3288 -3343 2015 -2441 -2154 -2638 -1107 -1730 571 -299 2791 -507 -1041 4063 -4128 1797 -1672 2616 1734 22 -736 3848 549 -536 -358 -3177 577 -1020 2297 -495 1542 1031 1646 -959 -1417 1160 -3523 1241 -1679 -124 -2565 -737 319 -1964 434 72 1583 164 1657 501 389 386 1128 1600 -810 1081 -506 1257 -912 526 -901 -643 -1756 -1159 -1060 377 518 -898 1294 -363 1263 340 -205 -59 -60 -441 -448 -1117 -1168 126 -743 -448 1263 -22 -849 655 829 104 832 -176 241 -992 551 898 -513 1203 742 -498 -365 505 -816 -506 -211 -43 -1053 1453 -1272 1321 -1117 -396 -966 1081 -256 -577 -60 -418 1786 28 1917 712 -989 1145 1035 1363 -1125 631 210 856 -1319 2038 -885 -249 1038 -362 1801 -1273 2802 -1098 329 -379 -725 -1645 -1040 1330 -1491 872 -1109 -980 -1201 -489 -763 249 -137 1324 -264 -573 2207 -2482 1039 -1001 1485 987 13 -467 2525 396 -399 -255 -2181 370 -692 1666 -403 1301 883 1363 -768 -1043 759 -2282 785 -1199 -98 -2287 -695 314 -2092 482 85 1903 201 1961 567 406 372 1032 1500 -843 1223 -640 1674 -1257 686 -1107 -741 -2037 -1410 -1369 503 720 -1329 1985 -597 2104 564 -325 -87 -83 -596 -618 -1637 -1813 200 -1189 -698 1878 -32 -1176 855 1062 139 1183 -267 379 -1615 912 1550 -943 2252 1426 -977 -708 942 -1486 -892 SS 20220524T072527.1Z 8179.309341 235 1 5.17 2 55.07 102.07 61.55 188.37 0.00 1 0.00 1 0 17 1.189e-02 5.918e-03 1.343e-02 4.793e-03 2.821784e-01 2.539631e-03 3.750130e-03 -6.000000e+00 7.196910e-03 231.80 -2.00 3.88 -2.00 316.89 0.00e+00 8.328729e-05 2.993497e-04 6.100744e-05 -6.000000e+00 2.846585e-04 277.23 -2.00 20.00 -2.00 316.58 0.00e+00 1.741 0.000 302.00 328.00 3 4.8984e+00 6.7011e-03 2.4038e-02 -6.0000e+00 1.8179e-02 4.4547e-02 7.4387e-03 1.6242e-02 -6.0000e+00 1.9686e-02 -7.2121e-03 4.4270e-03 7.9816e-03 -6.0000e+00 1.1536e-02 -4.6120e-04 2.1236e-03 2.2374e-03 -6.0000e+00 4.7580e-03 4.7667e-04 -6.6073e-04 1.4716e-04 2.8476e-05 -6.0000e+00 3.5703e-04 -1.8858e-02 -5.9864e-05 12 1 1 12 1 1 99.28 22.25 0.34 -0.01886 -0.02382 3 8 1 5 0 1247.964 25.28 19.99 22.25 23.60 29.3 1002.15 1241 -5671 3412 -1961 1809 2387 -1611 -2601 1747 765 -2263 4263 -2491 -811 445 2272 -1144 -551 -947 1676 44 2021 -1438 3 -635 -1254 1040 -1251 3099 1164 686 1246 40 -1716 -449 -2525 -928 706 -931 584 -1311 641 -1634 -1062 -1090 -1137 -218 -202 792 33 1845 524 1350 803 1261 1335 240 360 -444 1106 733 544 354 -372 156 -392 -1043 287 -121 1159 -101 -385 -574 -243 -234 383 362 1002 467 -22 -88 -1123 -810 -1468 -797 -215 -693 62 -89 285 171 990 865 976 840 588 736 534 -314 -219 -923 -737 -237 270 29 -637 -936 -753 23 148 -29 13 388 -308 268 225 466 289 256 16 -672 13 -697 737 314 -173 665 410 475 -260 638 116 128 -180 -188 226 -62 475 -409 -275 283 -400 -388 147 -782 446 -259 214 269 -195 -350 249 116 -358 656 -444 -161 98 539 -294 -147 -262 468 13 577 -430 1 -206 -423 345 -408 932 349 214 414 14 -641 -162 -912 -348 293 -449 314 -773 389 -1034 -677 -696 -725 -137 -125 482 20 1153 347 930 577 928 1000 184 276 -340 832 560 434 298 -330 139 -341 -868 231 -101 1023 -96 -379 -571 -237 -219 337 297 785 373 -19 -82 -1118 -847 -1598 -898 -251 -845 77 -111 351 203 1107 917 1002 879 650 868 671 -415 -292 -1202 -915 -282 320 36 -820 -1244 -1028 32 214 -43 20 586 -453 375 302 614 386 354 22 -994 19 -1019 1047 434 -233 866 528 627 -359 910 170 190 -273 -293 363 -102 790 -687 -460 464 -642 -612 SS 20220524T073953.6Z 8179.319371 242 1 2.30 2 52.96 105.33 61.87 192.33 0.00 1 0.00 1 0 25 1.112e-02 6.003e-03 7.641e-03 3.432e-03 2.676199e-01 1.830929e-03 3.576793e-03 -6.000000e+00 6.735585e-03 231.80 -2.00 3.88 -2.00 316.35 0.00e+00 -1.110569e-04 1.887601e-04 4.743142e-05 -6.000000e+00 2.663275e-04 277.23 -2.00 20.00 -2.00 316.04 0.00e+00 1.656 0.000 302.00 328.00 3 3.6927e+00 4.8042e-03 2.2824e-02 -6.0000e+00 1.7014e-02 2.2059e-02 5.3226e-03 1.5396e-02 -6.0000e+00 1.8420e-02 -2.4325e-03 3.0951e-03 7.5584e-03 -6.0000e+00 1.0795e-02 -1.3335e-03 1.4326e-03 2.1127e-03 -6.0000e+00 4.4545e-03 1.7900e-03 -3.2097e-04 1.0530e-04 2.7934e-05 -6.0000e+00 3.3390e-04 -1.9502e-02 5.6492e-05 12 1 1 12 1 1 99.70 22.25 0.22 -0.01950 -0.02191 4 23 1 5 0 422.395 25.39 20.00 22.25 24.03 29.4 1003.00 127 -2778 -2931 -3795 -708 1129 -1004 3940 -2533 1932 -3919 2215 -1711 -1490 400 -1645 655 -307 544 -1698 2716 -100 2493 110 289 -504 54 1468 208 2850 -245 2443 1483 282 -1465 -1307 -336 -30 -160 -1182 -462 -1036 -542 -1438 -891 -517 -898 -303 -733 831 -499 604 795 925 284 484 1030 50 554 793 1569 792 1741 180 604 57 -159 1014 593 9 -343 417 -213 -207 -359 119 -164 797 887 12 -238 -997 -991 -1313 -1113 -821 -212 -446 -764 -478 -204 719 588 1048 781 -55 388 621 -372 -384 -333 -910 -83 224 -438 -505 -183 -809 124 -27 -4 71 -143 149 303 577 171 492 311 -293 55 -240 -184 -56 556 117 836 1035 542 264 794 -14 128 365 208 -306 -439 264 -264 -10 -408 -696 -326 20 -496 -538 -678 -114 172 -161 664 -493 381 -822 452 -389 -377 111 -500 205 -100 181 -591 933 -35 873 41 111 -202 22 562 77 1013 -91 948 612 121 -622 -545 -145 -14 -86 -713 -297 -696 -371 -999 -618 -357 -617 -205 -491 551 -343 429 587 706 222 386 828 40 444 632 1261 664 1519 165 557 51 -137 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