File name: Pandora21s1_Bremen_20220730_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T115257.6Z 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_20220730_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: 20220730 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 20220730T064741.2Z 8246.283116 161 1 5.57 2 63.90 93.69 76.26 79.15 0.00 1 0.00 1 0 25 1.999e-02 6.417e-03 2.228e-02 4.434e-03 3.469798e-01 2.354675e-03 4.585692e-03 -6.000000e+00 1.217784e-02 233.37 -2.00 3.88 -2.00 317.97 0.00e+00 5.014304e-04 3.659357e-04 1.062736e-04 -6.000000e+00 4.788544e-04 282.77 -2.00 20.00 -2.00 317.65 0.00e+00 2.259 0.000 302.00 328.00 3 4.2980e+00 6.3292e-03 3.0615e-02 -6.0000e+00 3.0881e-02 -4.1619e-03 7.0411e-03 2.0271e-02 -6.0000e+00 3.3397e-02 -5.9162e-03 4.5785e-03 9.9662e-03 -6.0000e+00 1.9547e-02 1.1422e-03 2.3470e-03 2.8042e-03 -6.0000e+00 8.0377e-03 4.8749e-04 -5.7185e-04 1.3723e-04 3.4096e-05 -6.0000e+00 6.0078e-04 -1.8340e-02 1.5788e-05 12 9 1 12 1 1 98.06 22.36 0.21 -0.01834 -0.02264 4 9 1 5 0 1077.532 25.47 20.00 22.36 26.18 30.1 1017.11 2738 -9060 -5394 4914 -5724 4114 -4281 -216 -1057 -5403 -4504 -6599 1696 3029 4776 -603 2484 -2366 535 -4120 -2677 -548 4833 2349 -286 2568 -1659 1210 -1522 5858 -2133 1447 2022 851 -716 125 1914 -3612 -1326 -949 -134 -2022 68 -1808 -625 -951 -2237 -430 -522 1275 -324 380 831 1357 797 323 989 195 1914 -354 1898 1230 1341 1241 646 -221 628 659 265 808 -259 71 -584 -566 -59 -149 38 -1336 621 -683 -344 -830 -540 -1803 -1098 -294 -1027 -388 211 181 478 474 19 912 1204 717 1036 639 -253 -801 -19 -417 -111 -196 -699 -1010 -477 -42 -160 508 87 214 -505 195 400 764 542 392 42 -560 -1031 -265 -82 -284 284 277 912 1026 506 477 285 48 39 251 -131 -535 47 316 -254 -359 -56 -432 95 153 -628 -377 304 -364 231 -271 -15 -80 -451 -383 -600 159 325 581 -86 369 -387 90 -747 -492 -100 858 448 -59 540 -365 252 -312 1120 -462 331 499 221 -185 32 506 -1135 -475 -387 -60 -959 33 -898 -310 -474 -1123 -211 -256 626 -168 208 478 813 496 207 641 128 1226 -230 1230 840 973 951 507 -170 461 475 198 651 -225 64 -534 -508 -51 -120 29 -979 459 -548 -300 -784 -539 -1887 -1191 -332 -1210 -467 255 215 546 514 20 915 1236 785 1217 806 -336 -1080 -25 -521 -133 -234 -867 -1308 -636 -57 -228 748 134 336 -792 296 582 1067 747 549 61 -846 -1595 -408 -124 -423 410 389 1241 1383 704 696 434 75 63 408 -220 -932 84 568 -460 -647 -99 -746 161 SS 20220730T065228.7Z 8246.286443 164 1 15.95 2 63.18 94.67 75.59 80.05 0.00 1 0.00 1 0 25 3.097e-02 6.156e-03 2.249e-02 3.964e-03 3.390741e-01 2.102087e-03 4.463929e-03 -6.000000e+00 1.887371e-02 233.37 -2.00 3.88 -2.00 318.26 0.00e+00 7.322771e-04 3.528572e-04 1.130317e-04 -6.000000e+00 7.420289e-04 282.77 -2.00 20.00 -2.00 317.94 0.00e+00 2.204 0.000 302.00 328.00 3 5.0025e+00 5.6746e-03 2.9897e-02 -6.0000e+00 4.7861e-02 2.1195e-02 6.3306e-03 1.9821e-02 -6.0000e+00 5.1754e-02 -9.9952e-04 4.2430e-03 9.7749e-03 -6.0000e+00 3.0292e-02 -5.2652e-03 2.1972e-03 2.7689e-03 -6.0000e+00 1.2460e-02 2.5337e-04 -3.0317e-04 1.2402e-04 3.3251e-05 -6.0000e+00 9.3069e-04 -1.9445e-02 6.2542e-05 12 1 1 12 1 1 98.38 22.36 0.28 -0.01945 -0.02172 6 4 1 5 0 2253.564 25.47 20.00 22.36 26.41 30.1 1018.79 -12430 -22558 -2519 -14923 3743 -1633 5805 -7284 -160 -5106 -6133 -2558 -1027 3059 877 6343 -4129 1884 -101 1107 -235 3282 6146 -4741 -812 -2047 710 -1719 993 -1126 756 1874 -1666 1974 -1406 1558 -4697 1151 -1024 690 118 -972 -432 -401 -448 -1404 160 -758 170 -416 1009 -305 774 757 135 1200 -85 578 -163 1430 977 1764 541 1166 1369 369 294 -317 1424 1076 -105 -365 163 -469 -317 460 -306 63 -246 8 -462 -1064 -1823 -1482 -1445 -781 275 -91 420 -353 458 -90 376 667 715 647 116 549 -278 -919 -232 39 -318 481 -820 -794 -587 -217 306 76 568 -102 779 -29 10 447 298 158 -468 -552 -931 -116 -90 308 146 324 132 1008 670 153 665 -92 668 115 8 32 141 332 -475 -74 -404 -412 -382 -689 -1535 -148 -959 188 -83 287 -451 -10 -366 -455 -193 -85 284 96 737 -569 259 -15 168 -37 506 944 -847 -148 -394 134 -323 174 -200 140 375 -375 449 -324 344 -1163 309 -329 252 48 -421 -193 -182 -205 -649 73 -344 77 -191 477 -156 415 426 79 717 -52 355 -100 859 600 1134 377 856 1026 270 206 -218 1003 828 -88 -321 144 -408 -262 353 -219 43 -173 6 -388 -977 -1792 -1520 -1551 -878 321 -109 506 -420 520 -96 379 652 717 695 135 691 -371 -1248 -305 48 -377 566 -1014 -1028 -787 -300 438 114 886 -164 1236 -45 15 628 411 222 -687 -845 -1462 -181 -138 461 212 456 180 1353 930 224 1019 -147 1076 191 13 57 258 614 -888 -137 -733 -730 -662 SS 20220730T071143.6Z 8246.299811 174 1 49.48 2 60.31 98.70 72.84 83.70 0.00 1 0.00 1 0 25 9.725e-03 5.128e-03 1.935e-03 3.832e-04 3.063478e-01 2.029823e-04 4.050232e-03 -6.000000e+00 5.926080e-03 233.37 -2.00 3.88 -2.00 318.18 0.00e+00 3.604244e-04 3.302828e-05 9.558950e-05 -6.000000e+00 2.329778e-04 282.77 -2.00 20.00 -2.00 317.86 0.00e+00 2.010 0.000 302.00 328.00 3 1.7399e+00 5.4665e-04 2.7158e-02 -6.0000e+00 1.5028e-02 -1.8751e-02 6.0964e-04 1.7917e-02 -6.0000e+00 1.6250e-02 1.1439e-03 3.9937e-04 8.8233e-03 -6.0000e+00 9.5112e-03 -3.1609e-03 2.0463e-04 2.4978e-03 -6.0000e+00 3.9125e-03 8.5727e-03 -1.8902e-04 1.2115e-05 3.0557e-05 -6.0000e+00 2.9219e-04 -1.9796e-02 6.7847e-05 10 0 0 10 0 0 67.85 22.37 0.18 -0.01980 -0.02122 865 170 1 5 0 55.402 25.47 20.00 22.37 27.64 30.4 1025.34 -3426 -1378 -4445 -2529 -3619 -1679 -3076 -1382 -520 -1909 -1246 -1653 -713 -1793 -883 -1417 -845 -699 -163 109 -113 650 259 382 -518 -127 -971 -398 512 800 690 908 451 -910 -565 -570 -470 -832 -551 -1067 -1131 -812 -911 -566 -470 -481 -643 -540 -335 487 669 722 959 626 707 668 739 438 734 940 1231 1329 1117 707 61 445 337 774 793 564 -68 -210 -268 -422 -129 -5 396 476 566 -154 -429 -1040 -1470 -1126 -1035 -814 -513 -300 -183 -146 288 409 795 1063 1047 660 799 338 -379 -565 -396 -535 155 229 -633 -601 -634 -382 -110 75 -39 -168 -98 -52 176 535 645 418 203 -403 -615 -303 -327 -52 296 348 821 1221 819 567 323 170 270 382 41 -97 4 -22 -364 -302 -306 -391 -169 -209 -91 -315 -170 -226 -98 -189 -93 -39 -153 -101 -140 -67 -196 -110 -198 -126 -109 -27 18 -20 113 46 71 -104 -26 -204 -80 97 149 134 193 104 -222 -134 -133 -116 -239 -188 -398 -470 -358 -417 -262 -219 -224 -297 -245 -150 219 314 363 514 356 419 407 459 274 452 573 765 877 802 545 45 336 239 530 566 448 -56 -183 -237 -364 -104 -4 283 320 388 -118 -345 -936 -1440 -1166 -1138 -897 -597 -363 -223 -174 321 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