File name: Pandora21s1_Bremen_20220413_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T103602.7Z 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_20220413_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: 20220413 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 20220413T062736.7Z 8138.269175 260 1 15.23 2 73.44 97.02 108.35 323.98 0.00 1 0.00 1 0 25 8.453e-02 5.682e-03 5.787e-02 2.890e-03 5.001017e-01 1.522624e-03 6.445998e-03 -6.000000e+00 5.037349e-02 227.44 -2.00 3.88 -2.00 319.77 0.00e+00 6.391974e-04 4.086138e-04 2.999512e-04 -6.000000e+00 2.024575e-03 271.92 -2.00 20.00 -2.00 319.48 0.00e+00 3.454 0.001 302.00 328.00 3 3.0317e+00 4.2264e-03 4.4887e-02 -6.0000e+00 1.2593e-01 3.1797e-02 4.9640e-03 2.8787e-02 -6.0000e+00 1.3680e-01 -1.3773e-02 4.5482e-03 1.4933e-02 -6.0000e+00 8.0439e-02 -1.5779e-03 2.4362e-03 4.5726e-03 -6.0000e+00 3.3473e-02 4.5215e-04 -8.7225e-04 8.9023e-05 5.5373e-05 -6.0000e+00 2.5362e-03 -1.7837e-02 -7.8271e-06 12 1 1 12 1 1 99.93 22.28 0.20 -0.01784 -0.02439 28 19 1 5 0 519.017 25.28 20.00 22.28 19.16 29.1 1014.90 9877 -54031 -4000 -30334 -9161 3295 18639 -22592 -40851 -9065 -25398 -23118 -27663 4500 -9994 1800 -5262 14101 -3088 -3865 11877 -5639 2600 -7160 4616 -9918 1844 -12116 1838 5579 2139 7417 2884 1711 -5876 1503 -4344 -1491 -412 -1232 -2333 964 -1838 -1810 1829 -1834 1306 -802 -908 -1234 -622 1396 -349 1826 994 802 26 1267 -924 303 765 2917 1198 67 1554 424 1265 -46 1061 655 440 19 -27 87 -229 988 99 764 412 -297 -703 -975 -1765 -1276 -1094 -1119 -675 -161 209 -25 658 868 1427 1276 1217 507 454 533 -417 -488 -18 -591 159 45 -900 -789 -563 -378 -28 -69 -224 -78 -113 55 159 712 260 610 -134 -469 -654 -102 -211 -19 251 -103 656 991 744 284 202 53 109 416 21 -40 25 134 -457 -220 -345 -186 117 106 -1120 -57 -556 -127 42 217 -422 -975 -182 -598 -583 -862 125 -366 68 -240 576 -161 -214 582 -335 147 -481 299 -744 132 -926 126 377 166 628 273 175 -645 152 -501 -195 -65 -231 -477 206 -424 -429 423 -445 310 -197 -228 -325 -176 424 -118 649 377 303 10 493 -380 121 311 1187 549 34 818 222 635 -23 569 397 283 13 -19 58 -142 576 53 397 227 -187 -489 -770 -1475 -1134 -1033 -1080 -686 -169 220 -26 662 808 1240 1093 1109 520 507 644 -555 -639 -24 -713 182 51 -1078 -965 -724 -514 -39 -105 -357 -126 -184 90 244 1066 382 918 -207 -762 -1088 -167 -334 -29 380 -150 911 1423 1099 447 347 94 200 768 41 -81 52 284 -982 -464 -698 -369 223 SS 20220413T063248.5Z 8138.272784 263 1 49.80 2 72.67 98.09 108.80 325.17 0.00 1 0.00 1 0 25 6.724e-02 5.113e-03 7.365e-02 3.104e-03 4.853146e-01 1.651081e-03 6.228058e-03 -6.000000e+00 4.007465e-02 227.44 -2.00 3.88 -2.00 320.16 0.00e+00 -2.799923e-04 4.827097e-04 3.259034e-04 -6.000000e+00 1.610575e-03 271.92 -2.00 20.00 -2.00 319.85 0.00e+00 3.308 0.001 302.00 328.00 3 3.6851e+00 4.6630e-03 4.3319e-02 -6.0000e+00 1.0018e-01 2.2024e-02 5.5681e-03 2.8097e-02 -6.0000e+00 1.0883e-01 7.7001e-03 5.3235e-03 1.4747e-02 -6.0000e+00 6.3993e-02 -1.2439e-02 2.8211e-03 4.5947e-03 -6.0000e+00 2.6630e-02 2.7492e-04 -6.8868e-04 9.9393e-05 5.8078e-05 -6.0000e+00 2.0175e-03 -1.7465e-02 1.9477e-05 10 0 0 10 0 0 99.96 22.28 0.19 -0.01747 -0.02264 102 20 1 5 0 488.185 25.28 20.00 22.28 19.55 29.1 1016.29 -32604 -8065 28673 14674 8784 5258 4256 -41094 13155 12766 6355 -25473 -7068 -3931 -15627 -12102 -11122 11489 -4606 -9028 -4138 -1086 10595 -2148 -52 -2083 560 -3215 106 -4103 2007 4056 6994 -2621 -1894 -698 -3382 -1513 -484 1096 -1817 2265 -253 -2028 -1157 -608 -150 -2809 -317 851 1928 1251 272 445 507 686 -246 13 -1527 775 1406 1294 1407 409 1032 125 1203 47 964 51 1501 160 99 -680 400 247 56 -425 167 -1364 -990 -1279 -909 -1108 -1009 -878 -396 33 -260 142 894 357 1524 1298 1366 964 995 432 -265 -397 -320 -136 373 325 -755 -688 -628 -202 -200 62 -7 -356 -19 45 163 466 544 190 -242 -350 -858 -321 -439 -169 144 294 758 1503 507 83 288 -222 453 9 58 -207 136 -6 -224 -81 -20 -235 -7 -459 -104 289 165 98 60 52 -814 185 194 107 -604 -164 -105 -544 -466 -467 427 -210 -448 -204 -53 483 -117 -3 -130 35 -202 6 -259 131 294 551 -240 -171 -62 -330 -168 -64 168 -322 416 -50 -416 -238 -126 -31 -604 -68 188 453 323 77 135 163 229 -85 5 -534 262 481 474 566 181 476 57 527 21 450 27 857 98 61 -410 224 126 26 -196 81 -751 -620 -901 -696 -904 -872 -806 -381 33 -261 138 821 308 1227 1031 1145 899 1040 505 -337 -515 -401 -158 402 346 -849 -819 -782 -264 -277 92 -11 -598 -32 74 253 686 786 281 -377 -571 -1436 -529 -705 -263 215 423 1049 2060 742 132 494 -402 844 17 118 -445 301 -14 -507 -182 -42 -487 -13 SS 20220413T063824.1Z 8138.276668 266 1 1.09 2 71.83 99.25 109.28 326.47 0.00 1 0.00 1 0 25 1.359e-01 1.205e-02 1.343e-01 1.019e-02 4.581902e-01 5.344096e-03 6.024729e-03 -6.000000e+00 8.108024e-02 227.44 -2.00 3.88 -2.00 318.84 0.00e+00 -1.465549e-03 1.107221e-03 1.997093e-04 -6.000000e+00 3.309440e-03 271.92 -2.00 20.00 -2.00 318.54 0.00e+00 3.166 0.001 302.00 328.00 3 2.8249e+00 1.4454e-02 4.1064e-02 -6.0000e+00 2.0260e-01 -2.0103e-03 1.6408e-02 2.6184e-02 -6.0000e+00 2.2010e-01 5.5086e-03 1.2722e-02 1.3312e-02 -6.0000e+00 1.2934e-01 -9.0846e-03 6.8635e-03 3.9509e-03 -6.0000e+00 5.3892e-02 7.8492e-04 -4.4139e-04 3.1024e-04 4.7087e-05 -6.0000e+00 4.1178e-03 -1.9186e-02 1.9611e-05 12 9 9 12 1 1 999.00 22.28 0.23 -0.01919 -0.02250 1 22 1 5 0 452.419 25.28 20.00 22.28 19.97 29.0 1017.76 -56117 7516 104787 43219 900000 -50435 26822 16896 -11470 -37851 -6339 -2015 -8376 -15750 11061 61 -11013 27248 -2381 29225 10998 8940 11004 -8437 -12229 -10378 10296 -12399 12057 7288 -3611 -6967 3407 -810 -5136 208 -5559 5198 -5505 4069 -4851 -3401 -1722 1968 -4157 -2003 3004 -2496 -852 1486 -165 -995 3109 -572 2452 383 642 496 2563 4097 1416 1908 531 3587 1566 3265 187 -237 1964 1018 1184 -1409 -721 -536 -1006 -1140 54 903 2036 -1395 135 -1304 -2615 -2052 -247 -181 -831 338 15 -1093 458 782 904 1965 1847 461 -348 -466 -1267 790 -585 -1931 -1273 119 -2261 -903 -452 -901 -198 644 657 246 648 -1347 1281 946 1894 -115 623 -842 -1532 77 -130 303 286 804 2052 -169 1310 -547 895 459 283 620 715 -1056 -193 -143 -343 -528 -465 441 -709 -2074 178 1105 777 900000 -1931 552 429 -421 -1906 -253 -83 -418 -988 640 4 -963 1817 -220 2130 975 821 1031 -1009 -1635 -1444 1214 -1744 1325 844 -497 -1104 545 -142 -928 36 -1069 1046 -1431 1132 -1610 -1187 -615 695 -1553 -740 1071 -932 -319 562 -67 -436 1410 -282 1235 202 347 270 1360 2130 761 1075 324 2283 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