File name: Pandora21s1_Bremen_20220824_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T121649.4Z 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_20220824_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: 20220824 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 20220824T062559.1Z 8271.268046 228 1 49.67 2 72.35 95.03 42.23 114.93 0.00 1 0.00 1 0 25 1.481e-01 8.394e-03 1.429e-01 7.445e-03 4.067686e-01 3.992661e-03 5.279801e-03 -6.000000e+00 8.962084e-02 231.50 -2.00 3.88 -2.00 319.98 0.00e+00 2.400075e-03 1.065801e-03 2.346431e-04 -6.000000e+00 3.548177e-03 281.90 -2.00 20.00 -2.00 319.65 0.00e+00 3.252 0.001 302.00 328.00 3 4.7190e+00 1.1237e-02 4.0343e-02 -6.0000e+00 2.2621e-01 -3.3707e-02 1.3025e-02 2.4013e-02 -6.0000e+00 2.4499e-01 4.7739e-02 1.1355e-02 1.2240e-02 -6.0000e+00 1.4361e-01 -2.4270e-02 6.0357e-03 3.6828e-03 -6.0000e+00 5.9277e-02 1.1598e-04 -8.0580e-04 2.4523e-04 4.7033e-05 -6.0000e+00 4.4490e-03 -1.7490e-02 5.9731e-05 11 9 0 11 8 0 99.99 22.46 0.29 -0.01749 -0.02355 125 25 1 5 0 397.316 25.58 19.99 22.46 27.39 30.1 1001.77 50811 -39033 -6300 20514 100703 -21422 82820 16992 17617 -942 -34458 23362 18132 53607 -1701 24399 3777 15813 -2606 -5921 4935 -13082 10867 -5091 3569 1329 -662 17276 6046 4307 -4654 -2709 -7531 10383 -4628 11206 6258 -1027 -3776 -6404 2383 -6063 1915 -2081 3621 -3383 -1302 -2983 -2190 -2885 -3304 1905 2775 3736 -971 3701 1023 1173 -960 318 1109 -1153 1957 -1516 2018 880 2026 1790 866 37 -570 1558 -1037 130 -2192 -935 895 951 -361 -445 -653 -1633 -2018 -1672 527 -2319 1055 -289 810 -312 -605 514 -845 1812 1477 1353 968 1192 -107 -306 -546 543 1171 -176 -784 -1656 -825 -560 800 426 303 260 -65 667 -471 869 302 404 -179 -755 -645 -467 -314 -33 17 -988 971 1146 731 350 557 -176 -16 1 -760 -544 -117 492 -279 65 -399 318 494 617 -1102 -145 375 901 -509 876 339 383 -25 -1252 568 519 1350 -77 1013 201 816 -166 -405 318 -993 693 -390 269 107 -55 1211 456 335 -420 -268 -854 1065 -536 1123 694 -139 -615 -1240 475 -1396 429 -497 835 -843 -321 -749 -553 -755 -920 548 852 1211 -344 1302 378 436 -361 118 417 -474 856 -742 993 428 932 815 419 20 -343 973 -672 81 -1318 -511 441 451 -180 -248 -415 -1169 -1577 -1385 454 -2191 1022 -294 827 -315 -581 454 -707 1439 1230 1244 1001 1372 -134 -395 -680 622 1247 -188 -887 -2010 -1045 -743 1111 638 486 435 -109 1072 -719 1241 425 581 -273 -1223 -1074 -775 -506 -51 26 -1438 1335 1561 1053 549 936 -313 -30 2 -1536 -1158 -257 1099 -633 146 -870 661 995 SS 20220824T064500.3Z 8271.281253 234 1 12.72 2 69.52 98.96 39.77 120.13 0.00 1 0.00 1 0 25 1.985e-02 5.168e-03 1.176e-02 1.720e-03 3.579685e-01 9.067928e-04 4.718663e-03 -6.000000e+00 1.201448e-02 231.49 -2.00 3.88 -2.00 318.53 0.00e+00 6.606777e-04 1.652713e-04 1.312717e-04 -6.000000e+00 4.756083e-04 281.90 -2.00 20.00 -2.00 318.22 0.00e+00 2.829 0.000 302.00 328.00 3 2.8212e+00 2.4530e-03 3.5127e-02 -6.0000e+00 3.0326e-02 -2.1594e-02 2.7460e-03 2.0856e-02 -6.0000e+00 3.2840e-02 -4.0911e-03 1.9204e-03 1.0349e-02 -6.0000e+00 1.9251e-02 -1.8715e-03 1.0108e-03 2.9740e-03 -6.0000e+00 7.9481e-03 1.2577e-03 -4.4811e-04 5.3900e-05 3.5788e-05 -6.0000e+00 5.9625e-04 -1.8957e-02 6.6049e-05 12 1 1 12 1 1 95.75 22.46 0.19 -0.01896 -0.02232 40 32 1 5 0 305.772 25.58 20.00 22.46 28.09 30.1 1005.33 4920 -5553 -8119 -6401 -5601 2955 -7045 6667 -6930 2582 -5140 -656 -5247 -2006 -3500 -2157 3510 -1264 3276 -1152 671 -2129 2251 -433 -2180 364 -2476 32 -1120 751 -1791 2149 -779 -942 -1765 -363 -721 -777 -1011 -1895 176 -1344 -393 -1065 -1165 -602 -661 -641 -725 1350 645 1077 434 1382 839 894 625 627 958 824 1472 1033 1724 713 609 232 768 764 540 510 -80 361 -291 -157 -455 360 -249 247 86 -571 -576 -1365 -1265 -1152 -816 -930 -213 -123 -49 38 16 243 13 1105 415 796 689 322 -276 -639 -309 -408 196 -68 -683 -915 -463 -444 66 -19 320 64 136 191 172 648 289 253 -79 -474 -623 -337 -52 -258 372 406 851 817 815 610 278 126 82 383 -168 127 -153 13 -331 -316 -493 -274 110 191 -264 -414 -314 -255 120 -328 304 -396 145 -318 -41 -384 -166 -340 -232 387 -154 404 -154 91 -299 312 -65 -352 60 -424 5 -178 117 -303 386 -157 -199 -369 -74 -157 -193 -296 -644 65 -532 -160 -444 -490 -254 -279 -268 -305 567 285 507 218 726 460 504 360 363 549 470 851 631 1124 497 436 162 513 501 369 379 -65 303 -248 -131 -364 268 -173 165 59 -428 -474 -1228 -1211 -1151 -850 -1018 -242 -144 -57 44 17 256 13 1070 415 850 797 403 -365 -858 -404 -506 232 -80 -842 -1180 -617 -612 94 -29 498 101 217 295 254 920 404 361 -118 -732 -985 -532 -80 -392 548 582 1182 1127 1160 916 437 204 136 649 -295 231 -285 25 -631 -598 -917 -497 195 SS 20220824T065155.3Z 8271.286057 238 1 14.37 2 68.50 100.41 38.91 122.12 0.00 1 0.00 1 0 25 2.888e-02 5.324e-03 2.003e-02 3.241e-03 3.446458e-01 1.708331e-03 4.528708e-03 -6.000000e+00 1.747887e-02 231.49 -2.00 3.88 -2.00 318.45 0.00e+00 1.041593e-03 3.029510e-04 1.234304e-04 -6.000000e+00 6.919012e-04 281.90 -2.00 20.00 -2.00 318.13 0.00e+00 2.703 0.000 302.00 328.00 3 4.1466e+00 4.6116e-03 3.3636e-02 -6.0000e+00 4.4119e-02 1.7454e-02 5.1564e-03 2.0023e-02 -6.0000e+00 4.7775e-02 -7.9258e-03 3.5434e-03 9.9191e-03 -6.0000e+00 2.8006e-02 1.0235e-04 1.8543e-03 2.8457e-03 -6.0000e+00 1.1563e-02 3.7478e-04 -3.5644e-04 1.0175e-04 3.3773e-05 -6.0000e+00 8.6734e-04 -1.9009e-02 8.1227e-05 12 1 1 12 1 1 99.66 22.46 0.28 -0.01901 -0.02169 12 9 1 5 0 1091.561 25.58 20.00 22.46 28.53 30.6 1008.83 -8057 -15134 -11103 4433 -11359 -10215 -1326 -928 9805 -4555 -1693 -14368 6829 -183 487 1663 -1647 -1860 -1736 -610 -1110 818 -1367 1290 -716 1526 -1395 -1585 4 881 402 -12 1957 -2171 -1870 -526 -410 -380 -1299 779 -2463 -223 -1010 -84 -797 444 685 -275 -568 401 1044 183 1650 256 1402 203 519 18 281 1697 996 1699 1294 1187 -655 512 711 -333 1477 1074 252 -279 -85 -226 8 -72 357 49 143 -298 -663 -1543 -1542 -1052 -1440 -941 -49 16 176 331 -61 -100 500 -28 88 554 752 489 126 -394 -554 -91 -140 57 -825 -729 -810 -135 -109 346 -111 88 276 -62 340 -40 348 398 288 -292 -407 -116 3 206 16 231 867 1072 161 266 447 298 293 -152 351 -296 -107 17 -325 -178 -250 -337 -116 -387 -877 -646 221 -592 -521 -64 -50 528 -292 -108 -1096 476 -16 49 188 -202 -242 -238 -86 -162 118 -206 199 -120 261 -247 -272 1 145 68 -2 396 -480 -404 -110 -91 -98 -390 269 -950 -90 -427 -36 -346 191 293 -117 -242 172 469 89 827 138 781 118 307 11 165 976 590 1035 863 830 -479 367 479 -221 1009 797 203 -239 -74 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