File name: Pandora21s1_Bremen_20210912_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T085759.4Z 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_20210912_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: 20210912 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 20210912T081246.2Z 7925.342202 156 1 5.27 2 62.33 124.45 120.91 82.99 0.00 1 0.00 1 0 25 2.393e-02 7.746e-03 1.836e-02 6.649e-03 2.575776e-01 3.481404e-03 3.449431e-03 -6.000000e+00 1.432797e-02 229.09 -2.00 3.88 -2.00 316.96 0.00e+00 -1.703222e-04 4.213896e-04 5.643036e-05 -6.000000e+00 5.733352e-04 279.92 -2.00 20.00 -2.00 316.65 0.00e+00 2.142 0.000 302.00 328.00 3 5.0744e+00 9.1506e-03 2.5907e-02 -6.0000e+00 3.5952e-02 3.1385e-02 1.0187e-02 1.4751e-02 -6.0000e+00 3.9035e-02 7.4145e-03 6.0844e-03 7.2762e-03 -6.0000e+00 2.2924e-02 -4.3413e-03 2.9256e-03 2.0651e-03 -6.0000e+00 9.4850e-03 2.9086e-04 -6.0063e-05 2.0667e-04 2.6572e-05 -6.0000e+00 7.1882e-04 -3.6112e-03 2.4657e-05 12 9 1 12 1 1 999.00 22.30 0.54 -0.00361 -0.00406 2 6 1 5 0 1699.908 25.39 20.00 22.30 25.40 27.2 997.10 -3237 7115 503 -3605 -15290 -6316 1133 -9950 -6675 -3987 4130 -1074 -5089 -4422 -1682 4153 -336 287 -2861 2670 4371 1771 47 2753 3532 1612 226 58 2805 2958 4548 1546 -2797 -3055 -1928 34 -2405 128 -1888 81 -1694 40 99 134 725 -2242 1628 -253 -391 1150 758 828 2262 838 495 888 -1150 566 316 1014 -167 579 567 174 1092 -1245 343 123 342 325 -253 150 -666 780 -172 -176 -238 -242 90 -517 -606 -1843 -1138 -961 -1656 -1170 -368 509 -134 -402 810 584 239 786 -10 387 1582 13 757 -537 194 -1104 161 -282 -523 -68 -280 -29 677 -444 181 315 -84 88 -288 642 -206 795 -517 -216 -390 239 -160 548 -203 -835 183 701 1496 126 722 -663 765 592 -655 -59 142 181 -411 -37 -272 138 -800 -407 881 68 -479 -2087 -767 135 -1449 -1035 -634 617 -174 -933 -908 -377 960 -85 75 -792 726 1195 497 14 818 1095 524 74 18 825 854 1344 501 -997 -1117 -679 12 -894 53 -912 43 -994 24 61 83 451 -1423 993 -154 -235 687 470 539 1525 594 360 658 -876 426 237 752 -127 460 476 153 957 -1067 277 97 279 286 -239 146 -657 746 -159 -152 -192 -188 71 -439 -559 -1835 -1186 -1038 -1874 -1381 -449 631 -168 -496 950 648 251 801 -10 428 1859 16 993 -713 248 -1359 190 -335 -649 -87 -373 -40 953 -653 273 483 -127 128 -401 853 -271 1061 -723 -313 -579 354 -234 781 -283 -1132 240 905 1977 176 1036 -979 1136 898 -1034 -96 236 304 -697 -62 -450 223 -1279 SS 20210912T081741.6Z 7925.345620 159 1 25.61 2 61.72 125.66 120.22 84.00 0.00 1 0.00 1 0 17 7.614e-03 4.826e-03 3.296e-03 9.836e-04 2.541887e-01 5.136857e-04 3.412442e-03 -6.000000e+00 4.558209e-03 229.09 -2.00 3.88 -2.00 317.47 0.00e+00 1.321157e-04 7.002945e-05 6.346352e-05 -6.000000e+00 1.823816e-04 279.92 -2.00 20.00 -2.00 317.14 0.00e+00 2.100 0.000 302.00 328.00 3 3.0119e+00 1.3589e-03 2.5496e-02 -6.0000e+00 1.1438e-02 1.1795e-02 1.5143e-03 1.4621e-02 -6.0000e+00 1.2418e-02 3.9786e-03 9.3003e-04 7.2332e-03 -6.0000e+00 7.2928e-03 -4.5115e-03 4.5853e-04 2.0644e-03 -6.0000e+00 3.0175e-03 2.4191e-03 -8.4507e-05 3.1075e-05 2.6223e-05 -6.0000e+00 2.2866e-04 -2.7070e-03 7.1751e-05 12 1 1 12 1 1 99.99 22.30 0.17 -0.00271 -0.00334 195 76 1 5 0 129.760 25.39 20.01 22.30 25.59 27.2 998.40 -2091 -1115 -2727 -3133 -1898 -55 1429 1702 -42 -1319 1101 60 -331 -655 -98 -593 -388 176 480 -330 595 453 591 51 244 128 -476 111 307 796 1176 1346 399 -1162 -617 -532 -851 -499 -446 -937 -1272 -903 -873 -941 -531 -510 -681 -509 -655 410 482 643 900 808 695 860 623 356 779 885 1304 1263 1012 587 -74 362 8 575 864 386 -102 -123 -246 -309 -133 141 154 239 403 -243 -574 -993 -1477 -1061 -885 -694 -410 -267 -104 -118 229 327 770 899 860 662 824 344 -220 -502 -150 -632 14 79 -682 -653 -596 -315 120 59 -20 -60 -100 -7 158 333 540 269 160 -305 -604 -172 -134 -9 352 209 877 983 705 459 254 182 26 222 1 -22 8 1 -232 -153 -347 -335 -240 -210 -121 -306 -335 -195 -5 143 188 -5 -164 135 8 -47 -106 -18 -119 -82 38 108 -78 142 108 144 13 66 36 -134 30 77 194 298 366 117 -357 -182 -154 -266 -180 -191 -440 -660 -492 -490 -535 -301 -288 -379 -276 -350 218 267 379 561 529 472 597 441 252 543 614 924 953 781 482 -61 283 6 429 673 316 -92 -117 -236 -288 -116 111 117 171 296 -198 -497 -953 -1531 -1096 -972 -814 -507 -325 -128 -148 269 350 796 889 878 699 962 444 -290 -667 -189 -783 17 92 -859 -832 -796 -440 175 87 -32 -96 -156 -10 223 440 698 358 227 -462 -907 -257 -206 -14 495 281 1174 1295 972 644 378 280 41 344 1 -37 14 1 -410 -267 -615 -573 -400 SS 20210912T082607.6Z 7925.351477 165 1 0.67 2 60.71 127.76 119.03 85.70 0.00 1 0.00 1 0 17 8.285e-03 5.867e-03 5.413e-03 2.710e-03 2.452521e-01 1.428700e-03 3.303044e-03 -6.000000e+00 4.960828e-03 229.08 -2.00 3.88 -2.00 316.13 0.00e+00 2.852867e-04 1.414880e-04 3.993420e-05 -6.000000e+00 1.984256e-04 279.92 -2.00 20.00 -2.00 315.83 0.00e+00 2.035 0.000 302.00 328.00 3 1.5959e+00 3.7213e-03 2.4613e-02 -6.0000e+00 1.2448e-02 -4.0555e-06 4.1335e-03 1.4013e-02 -6.0000e+00 1.3514e-02 9.4028e-04 2.3872e-03 6.9006e-03 -6.0000e+00 7.9368e-03 -2.1009e-03 1.0887e-03 1.9495e-03 -6.0000e+00 3.2841e-03 1.0848e-02 2.6247e-04 8.3559e-05 2.6463e-05 -6.0000e+00 2.4880e-04 6.6506e-04 2.4492e-04 12 1 1 12 1 1 38.35 22.30 0.18 0.00067 0.00264 6 139 1 5 0 70.140 25.39 19.99 22.30 25.94 27.3 999.88 -2413 -2466 -1246 -3561 -815 -1182 -1092 471 793 -1795 -1039 -79 280 -278 451 -245 -130 1168 392 953 651 906 1056 357 203 1048 214 269 1133 1735 1643 865 236 -880 -439 -1132 418 -1494 -938 -1123 -1165 -160 -722 -966 -749 -368 -300 -561 -769 554 392 676 1036 301 76 697 856 1023 121 705 762 1616 1021 107 185 -25 684 583 419 102 14 -296 172 -807 -526 447 641 473 244 -355 -867 -592 -1156 -1654 -1115 -813 -281 -628 -28 -97 310 24 -74 1042 1107 902 970 531 -411 -458 -348 -170 128 288 -263 -686 -977 -378 112 42 -181 -416 -415 100 105 660 621 317 391 -372 -74 -279 -350 142 107 490 736 1371 784 468 472 282 164 26 -68 -161 202 -161 -546 -321 -514 -360 -23 -472 -525 -267 -740 -150 -209 -201 95 175 -428 -248 -19 70 -80 137 -82 -46 423 141 351 245 341 404 144 86 435 89 112 442 657 647 369 103 -398 -191 -487 190 -763 -540 -717 -786 -108 -506 -686 -531 -259 -208 -396 -533 380 269 493 768 236 60 555 692 825 97 560 622 1391 920 100 173 -22 577 495 359 94 14 -296 173 -794 -501 411 552 385 204 -317 -841 -591 -1210 -1838 -1272 -960 -340 -768 -34 -119 365 27 -78 1075 1176 1012 1135 668 -527 -589 -438 -204 150 339 -322 -873 -1275 -499 154 60 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