File name: Pandora21s1_Bremen_20210411_L2Fit_fout2c12d20201116p1-8.txt File generation date: 20250430T194419.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c12p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v12d20201116.txt Level 1 file used: Pandora21s1_Bremen_20210411_L1_smca1c12d20201116p1-8.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: 20210411 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 20210411T154613.4Z 7771.657099 461 1 6.74 2 68.36 254.84 75.65 253.92 0.00 1 0.00 1 0 25 6.064e-02 6.234e-03 3.322e-02 2.749e-03 4.827781e-01 1.430484e-03 6.301492e-03 -6.000000e+00 3.603991e-02 227.31 -2.00 3.88 -2.00 318.98 0.00e+00 3.508014e-04 3.106060e-04 2.220493e-04 -6.000000e+00 1.452804e-03 271.71 -2.00 20.00 -2.00 318.68 0.00e+00 2.687 0.000 302.00 328.00 3 3.1110e+00 3.8780e-03 3.8644e-02 -6.0000e+00 9.0052e-02 3.0747e-02 4.4222e-03 2.7455e-02 -6.0000e+00 9.7926e-02 -6.4130e-03 3.5069e-03 1.3966e-02 -6.0000e+00 5.7587e-02 -4.5673e-03 1.8921e-03 4.1343e-03 -6.0000e+00 2.3892e-02 8.6575e-04 -7.1626e-04 8.2512e-05 4.9499e-05 -6.0000e+00 1.8209e-03 1.5395e-03 -1.4602e-05 12 1 1 12 9 1 94.04 22.31 0.17 0.00154 -0.00384 13 21 1 5 0 469.155 25.28 20.00 22.31 12.47 23.3 1005.52 -9090 -39460 20000 -16927 -8141 -14749 -4878 -31687 -2638 -10394 -19779 7485 -23686 -36 2225 -3294 2077 -641 339 -2655 1265 -2565 -687 -6362 -3863 -3586 -4707 318 -3077 276 95 2688 -3306 2414 709 2352 725 1760 -1380 -1966 -694 -2256 -109 -1673 1216 1142 -659 -1853 -919 613 1774 930 1143 676 1221 572 730 712 1111 405 1667 1415 775 -114 580 -6 920 973 882 502 -190 -248 45 -21 383 567 238 83 287 166 -66 -1869 -1847 -1421 -994 -885 -459 -510 -277 88 414 720 550 1749 342 1303 747 207 -207 -517 -290 -601 560 -378 -1182 -930 -747 -414 137 415 -111 95 -395 197 166 928 443 -78 119 -327 -836 -114 -152 -36 369 434 1140 1026 538 323 187 246 26 336 -45 -161 -108 -189 -129 -16 -392 -331 -102 -194 -1235 389 -446 -188 -356 -115 -1065 -76 -345 -750 243 -1182 -2 124 -220 145 -49 28 -232 110 -234 -64 -668 -426 -414 -554 35 -341 31 12 363 -522 380 112 366 123 343 -327 -542 -209 -730 -36 -570 408 387 -228 -653 -328 224 684 389 511 321 601 292 380 372 571 207 864 779 463 -73 381 -4 576 611 585 364 -148 -201 36 -17 285 393 156 53 193 123 -54 -1684 -1766 -1413 -1028 -955 -512 -580 -316 98 441 729 535 1679 346 1416 884 264 -279 -701 -381 -749 661 -448 -1457 -1190 -986 -564 195 618 -174 154 -637 309 251 1350 641 -116 181 -515 -1334 -179 -234 -54 541 619 1581 1429 785 500 304 412 45 591 -81 -303 -207 -367 -250 -30 -735 -601 -181 SS 20210411T160447.4Z 7771.669993 471 1 2.81 2 71.07 258.79 78.23 257.73 0.00 1 0.00 1 0 25 1.318e-01 9.146e-03 1.370e-01 7.644e-03 5.415254e-01 3.999796e-03 6.984843e-03 -6.000000e+00 7.835536e-02 227.31 -2.00 3.88 -2.00 319.41 0.00e+00 -1.292612e-04 9.903556e-04 2.932891e-04 -6.000000e+00 3.157792e-03 271.72 -2.00 20.00 -2.00 319.12 0.00e+00 3.045 0.001 302.00 328.00 3 3.5133e+00 1.0969e-02 4.3554e-02 -6.0000e+00 1.9579e-01 2.2189e-02 1.2746e-02 3.0872e-02 -6.0000e+00 2.1289e-01 -1.4575e-02 1.1190e-02 1.5906e-02 -6.0000e+00 1.2519e-01 2.9262e-03 6.0309e-03 4.7943e-03 -6.0000e+00 5.1958e-02 3.8643e-04 -5.9893e-04 2.2552e-04 5.7164e-05 -6.0000e+00 3.9577e-03 -8.1914e-04 -1.8644e-05 12 9 1 12 1 1 999.00 22.31 0.16 -0.00082 -0.00532 2 11 1 5 0 877.608 25.28 19.99 22.31 12.85 23.2 1006.33 -11462 -67171 22972 1257 -11394 -11607 -35748 -55308 -39541 -72537 -36093 -13223 -37258 -13811 10426 37016 1539 3138 -21062 15930 8043 25527 -63 4745 14679 -557 -1956 -19327 -5049 -4663 -2529 3822 2881 6997 -9047 7783 -4812 -595 -813 -2236 -460 1529 939 -1428 337 -2087 -472 -2658 402 1986 5769 -144 762 3060 384 182 -823 -597 -399 1413 2503 3348 -1280 -171 -417 178 1114 2095 1538 -109 528 -1099 -614 -1669 2538 428 1360 1800 -1458 1530 -764 -2255 -223 -1019 -401 -563 -394 -596 880 -833 262 109 435 1461 2038 -54 628 554 6 -1046 -598 -926 -93 506 -1408 -565 88 -951 -300 -378 -496 -383 385 7 562 1714 310 532 -978 -290 -1449 352 -405 535 685 764 678 1178 137 543 932 181 240 243 -11 -962 28 -24 -277 157 -255 -517 -69 -151 -1631 269 17 -168 -171 -698 -1444 -1006 -2667 -1021 -338 -1382 -503 365 1176 74 161 -1436 819 458 1265 -4 320 978 -45 -162 -1833 -415 -397 -236 385 327 810 -1199 890 -666 -92 -151 -489 -110 384 247 -392 92 -589 -133 -773 117 599 1811 -52 292 1227 165 81 -379 -275 -181 626 1123 1588 -684 -98 -247 104 631 1190 932 -73 379 -831 -462 -1229 1714 273 812 1058 -930 1056 -596 -1940 -202 -969 -396 -582 -422 -652 955 -896 269 107 409 1364 1995 -58 734 700 8 -1417 -785 -1150 -109 589 -1716 -712 114 -1289 -424 -565 -782 -622 625 12 861 2528 458 798 -1529 -464 -2353 559 -632 813 1013 1102 957 1665 204 859 1547 312 425 443 -21 -1887 56 -48 -558 311 -492 -970 -126 SS 20210411T162249.1Z 7771.682512 480 1 2.12 2 73.74 262.54 80.77 261.37 0.00 1 0.00 1 0 25 3.799e-01 1.481e-02 2.477e-01 1.235e-02 6.239851e-01 6.653095e-03 7.914241e-03 -6.000000e+00 2.299165e-01 227.31 -2.00 3.88 -2.00 319.96 0.00e+00 3.162530e-03 1.932656e-03 4.172151e-04 -6.000000e+00 9.644199e-03 271.72 -2.00 20.00 -2.00 319.68 0.00e+00 3.512 0.001 302.00 328.00 3 3.3154e+00 1.8558e-02 5.0252e-02 -6.0000e+00 5.7617e-01 7.7545e-02 2.2366e-02 3.5726e-02 -6.0000e+00 6.2805e-01 -6.2571e-02 2.2170e-02 1.8673e-02 -6.0000e+00 3.6637e-01 1.7361e-02 1.1773e-02 5.7477e-03 -6.0000e+00 1.5105e-01 2.6855e-04 -7.0470e-04 3.6239e-04 6.9657e-05 -6.0000e+00 1.1856e-02 6.5116e-04 -6.0109e-07 12 9 9 12 1 1 999.00 22.31 0.18 0.00065 -0.00464 1 10 1 5 0 965.155 25.28 20.00 22.31 12.89 23.2 1006.53 -136019 28657 -98135 900000 900000 -134063 900000 -119686 900000 -92778 282602 -42329 45851 900000 3454 -3713 -25714 900000 -7548 83003 -10950 13004 -25189 -10411 13005 -10195 131581 -22276 32767 37874 39726 6496 2415 -19360 -5936 19244 -8815 23024 -20488 10357 -13660 9962 -6232 -5510 14002 -2382 1175 -7901 13609 -3727 1110 2580 3794 39 -4431 2797 -911 5004 -287 4500 -4510 10342 261 4538 -1534 4327 -1154 -1474 6052 26 -355 -821 2032 -1842 1271 371 983 1198 -1010 3390 -1056 1154 -2812 -566 -3470 -986 2 -236 2596 -367 1396 436 2023 764 89 -1839 -198 -1085 -1348 262 -543 -751 133 439 -2063 -742 229 204 770 -607 -871 -549 1697 -385 974 150 806 -214 -850 -491 -241 577 -918 776 -1014 -427 668 958 157 1025 2158 760 1 1130 -1464 -678 722 797 -259 -345 -75 -696 -933 -2728 345 -1743 900000 900000 -3057 900000 -2855 900000 -2087 3400 -739 552 900000 75 -100 -946 900000 -280 1464 -454 443 -1249 -485 527 -534 2016 -1309 1188 1403 1660 426 186 -1935 -523 1357 -865 1971 -3090 1384 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