File name: Pandora21s1_Bremen_20210816_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T084521.0Z 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_20210816_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: 20210816 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 20210816T144932.8Z 7898.617741 448 1 50.49 2 55.85 244.39 86.52 135.51 0.00 1 0.00 1 0 25 2.373e-02 7.279e-03 1.813e-02 4.271e-03 2.771220e-01 2.251367e-03 3.680920e-03 -6.000000e+00 1.437737e-02 232.46 -2.00 3.88 -2.00 317.97 0.00e+00 -1.055747e-04 3.444765e-04 7.875892e-05 -6.000000e+00 5.684193e-04 282.70 -2.00 20.00 -2.00 317.65 0.00e+00 1.776 0.000 302.00 328.00 3 6.1192e+00 6.0364e-03 2.4184e-02 -6.0000e+00 3.6372e-02 5.3724e-02 6.7326e-03 1.6129e-02 -6.0000e+00 3.9394e-02 7.2780e-03 4.2817e-03 7.9481e-03 -6.0000e+00 2.3073e-02 -8.8991e-03 2.1563e-03 2.2472e-03 -6.0000e+00 9.4783e-03 1.3666e-04 -4.4664e-04 1.3568e-04 2.7925e-05 -6.0000e+00 7.1336e-04 -2.1375e-03 1.0688e-06 11 8 0 10 0 0 99.97 22.28 0.32 -0.00214 -0.00549 16 3 1 5 0 3154.855 25.39 20.00 22.28 22.41 26.7 985.43 -6071 5534 -4978 -7284 7637 -5628 -5713 -6563 7499 -6610 3991 -4696 4077 -4249 -908 1296 -1290 3356 -3728 4967 -3062 -919 -1022 -127 -5896 2855 -274 -2615 5131 2760 3611 336 3616 -3272 1474 -3254 798 -132 -1749 490 -1714 -775 -2461 1963 -628 354 -1235 -911 -557 -1140 895 708 2050 115 1849 -394 2192 851 1330 1034 1014 1050 1071 1994 -556 745 -501 1063 647 613 58 -578 887 -1134 371 -566 -1517 -1515 -731 -1329 -989 -416 -2066 77 -1431 -12 -826 710 172 -51 984 -309 738 -420 748 -26 956 444 -469 212 -476 -175 -917 436 -1623 -121 -720 201 -57 370 428 200 126 92 -40 -223 26 -1220 -93 -164 -532 352 57 624 388 265 638 1069 125 11 179 91 788 511 407 -276 590 46 -313 -411 -507 -550 -307 -480 428 -436 -621 521 -420 -449 -579 638 -680 376 -500 441 -568 -133 204 -221 573 -709 900 -613 -181 -206 -27 -1389 641 -63 -591 1021 553 751 78 873 -868 362 -826 209 -40 -641 203 -797 -376 -1249 968 -318 177 -620 -446 -269 -558 448 378 1145 69 1124 -250 1385 545 838 650 652 716 784 1529 -440 555 -354 722 462 482 50 -523 798 -1011 308 -434 -1074 -1020 -501 -1004 -828 -379 -2045 79 -1564 -14 -1001 876 215 -62 1122 -330 725 -402 730 -28 1104 562 -633 286 -619 -212 -1064 503 -2016 -157 -977 282 -83 568 687 328 204 141 -58 -304 35 -1686 -134 -250 -835 548 87 921 550 360 832 1371 168 15 268 141 1232 825 685 -489 1068 86 -586 -763 -917 -964 -525 SS 20210816T145847.4Z 7898.624160 454 1 49.99 2 57.12 246.62 85.61 137.38 0.00 1 0.00 1 0 17 1.819e-02 5.817e-03 1.801e-02 3.959e-03 2.820253e-01 2.086801e-03 3.744100e-03 -6.000000e+00 1.102409e-02 232.46 -2.00 3.88 -2.00 318.16 0.00e+00 3.152293e-04 3.346261e-04 8.405877e-05 -6.000000e+00 4.357216e-04 282.69 -2.00 20.00 -2.00 317.83 0.00e+00 1.835 0.000 302.00 328.00 3 5.7245e+00 5.6084e-03 2.4821e-02 -6.0000e+00 2.7889e-02 4.3688e-02 6.2614e-03 1.6433e-02 -6.0000e+00 3.0204e-02 8.0949e-03 4.0471e-03 8.1101e-03 -6.0000e+00 1.7691e-02 -8.9061e-03 2.0540e-03 2.3010e-03 -6.0000e+00 7.2691e-03 1.9052e-04 -2.7552e-04 1.2640e-04 2.8613e-05 -6.0000e+00 5.4680e-04 -2.9541e-03 4.0464e-05 10 0 0 10 0 0 99.99 22.28 0.27 -0.00295 -0.00502 47 9 1 5 0 1063.546 25.39 20.00 22.28 22.79 26.7 987.24 933 -6656 -1202 1790 -4221 3659 -4755 4197 -338 2154 970 -10603 1958 -4684 -1696 -4539 2901 -1632 7819 666 743 -322 101 1822 -1153 1640 -1320 398 -700 1410 -640 4259 -664 -1640 -1115 -374 22 -164 -214 -2391 -810 -339 -91 -506 123 -207 -1752 -781 -1064 -15 -1933 1321 868 1086 883 -230 1452 591 753 -211 1967 1737 961 973 -401 367 513 986 -130 396 -436 322 -236 363 -474 147 -100 24 -205 -286 1 -1380 -1468 -1365 -472 -455 -174 130 67 665 258 448 -169 593 -72 400 1031 317 12 -501 17 -1058 656 -410 -846 -1073 -636 282 322 302 -75 162 168 -65 -353 364 389 194 -44 -1029 -459 -442 -74 -105 540 583 876 741 232 422 489 380 171 515 -154 132 284 10 -223 -187 -505 -479 -127 65 -539 -95 132 -304 236 -348 313 -29 189 87 -1108 201 -585 -234 -706 445 -273 1247 118 134 -59 19 352 -242 347 -287 82 -138 269 -131 897 -158 -405 -266 -87 5 -47 -73 -961 -353 -155 -43 -242 59 -99 -841 -364 -492 -7 -951 671 470 617 520 -140 887 365 458 -129 1207 1134 680 729 -307 266 348 650 -91 304 -366 282 -209 311 -386 109 -68 15 -136 -209 1 -1246 -1420 -1388 -504 -516 -207 160 82 797 293 470 -165 555 -70 420 1181 399 17 -679 21 -1289 748 -474 -1039 -1397 -861 394 471 465 -122 268 273 -101 -513 496 520 266 -64 -1586 -726 -698 -114 -157 770 796 1144 958 314 605 738 592 273 843 -266 238 526 19 -427 -353 -931 -856 -221 SS 20210816T150326.6Z 7898.627391 457 1 51.95 2 57.76 247.72 85.17 138.33 0.00 1 0.00 1 0 25 8.661e-03 5.257e-03 6.520e-04 1.720e-04 2.799278e-01 9.085395e-05 3.736494e-03 -6.000000e+00 5.248585e-03 232.46 -2.00 3.88 -2.00 317.63 0.00e+00 1.270713e-04 1.281753e-05 7.393805e-05 -6.000000e+00 2.074986e-04 282.69 -2.00 20.00 -2.00 317.30 0.00e+00 1.868 0.000 302.00 328.00 3 4.3475e-01 2.4256e-04 2.4962e-02 -6.0000e+00 1.3278e-02 -3.2558e-03 2.6958e-04 1.6312e-02 -6.0000e+00 1.4381e-02 2.8416e-03 1.6762e-04 8.0266e-03 -6.0000e+00 8.4230e-03 -3.3203e-03 8.3439e-05 2.2575e-03 -6.0000e+00 3.4603e-03 3.7745e-02 -4.1484e-04 5.4084e-06 2.8342e-05 -6.0000e+00 2.6040e-04 -2.3951e-03 2.8026e-06 10 0 0 10 0 0 99.30 22.28 0.27 -0.00240 -0.00551 3145 617 1 5 0 15.549 25.39 20.00 22.28 22.98 26.6 987.93 -2785 -2954 -3325 -3341 -2236 -1639 -1463 -966 -897 -1350 -1017 -591 -909 -766 -743 -998 -498 -133 89 57 168 575 659 266 29 -111 -469 -137 636 998 991 1203 536 -801 -718 -323 -714 -393 -574 -982 -1010 -830 -808 -670 -472 -520 -494 -543 -135 530 619 749 848 744 624 845 700 606 812 1033 1226 1259 1094 440 -20 239 306 701 868 325 -240 -295 -389 -367 -200 125 358 555 584 -115 -498 -1105 -1388 -1124 -1005 -916 -573 -396 -272 -178 216 307 791 1108 1021 752 785 302 -400 -497 -390 -429 273 237 -613 -583 -590 -418 -14 40 -59 -171 -133 -49 199 582 590 465 149 -371 -604 -248 -288 -17 321 412 989 1164 781 541 302 133 230 375 -24 -131 19 -61 -416 -273 -340 -379 -197 -240 -280 -323 -308 -187 -131 -123 -90 -92 -147 -112 -67 -115 -111 -123 -182 -96 -27 19 12 37 127 148 63 7 -29 -123 -34 149 229 238 313 151 -235 -204 -90 -215 -137 -239 -440 -499 -433 -435 -364 -256 -282 -264 -284 -69 273 334 431 519 480 418 579 489 424 559 707 859 940 822 353 -16 184 236 525 633 265 -216 -279 -372 -340 -173 98 274 402 434 -88 -432 -1067 -1449 -1155 -1097 -1069 -706 -504 -348 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