File name: Pandora21s1_Bremen_20210527_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T073559.5Z 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_20210527_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: 20210527 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 20210527T063946.9Z 7817.277626 266 1 2.54 2 61.49 91.92 113.78 260.82 0.00 1 0.00 1 0 25 5.018e-02 1.008e-02 3.733e-02 7.786e-03 3.798950e-01 4.108211e-03 4.995617e-03 -6.000000e+00 3.035493e-02 232.04 -2.00 3.88 -2.00 317.78 0.00e+00 -5.336590e-04 6.140082e-04 1.119329e-04 -6.000000e+00 1.202249e-03 277.60 -2.00 20.00 -2.00 317.47 0.00e+00 2.085 0.000 302.00 328.00 3 4.3079e+00 1.0983e-02 3.0638e-02 -6.0000e+00 7.6711e-02 5.0372e-02 1.2248e-02 2.1891e-02 -6.0000e+00 8.3119e-02 -1.9260e-02 7.8430e-03 1.0798e-02 -6.0000e+00 4.8699e-02 3.7086e-03 3.9977e-03 3.0422e-03 -6.0000e+00 2.0017e-02 5.2767e-04 -2.8738e-04 2.3631e-04 3.6881e-05 -6.0000e+00 1.5087e-03 -1.0999e-03 -3.6024e-05 12 9 9 12 1 1 999.00 22.32 0.36 -0.00110 -0.00326 1 8 1 5 0 1180.402 25.28 20.00 22.32 17.32 24.9 995.03 -1429 -6065 -20753 -13260 20465 -28802 12579 4039 10990 -18096 -10622 -4287 13012 8054 3999 8175 -4317 -321 983 1699 -6627 -65 7174 -5353 3031 -6100 2054 -2945 3760 -2253 4122 4977 2544 401 -5568 3571 -2456 -1111 -1351 2379 -2351 -916 -444 496 852 -3840 -1060 -3184 -15 863 1277 1950 742 -1284 878 2653 566 2860 -997 2160 261 1423 1289 -351 894 838 2462 1749 2967 -318 426 -759 371 -458 385 -173 -231 134 -382 22 -1191 -222 -1831 -1664 -2127 -1765 -686 -745 -140 198 -547 564 391 1180 -817 147 504 1140 -548 -588 -284 -113 -77 194 -593 -681 -794 1056 862 297 726 -1714 423 18 508 -174 1035 189 -342 -1015 -185 -182 -98 723 -377 1116 1515 333 698 872 528 -90 104 22 -17 -190 96 -96 284 418 -717 -711 -897 -87 -425 -1714 -986 1046 -2253 718 279 789 -1794 -1014 -410 1200 899 530 1158 -730 -55 175 312 -1338 -13 1337 -1176 658 -1486 468 -677 787 -498 920 1205 679 112 -1607 951 -735 -374 -527 1019 -1131 -456 -226 254 436 -2038 -549 -1665 -8 449 692 1113 450 -824 573 1749 385 1915 -678 1429 178 1009 970 -281 718 655 1839 1302 2286 -270 382 -708 344 -417 334 -142 -178 100 -296 18 -1086 -216 -1888 -1778 -2368 -2041 -815 -903 -169 235 -627 611 406 1200 -868 166 605 1452 -735 -792 -371 -140 -92 232 -739 -880 -1058 1433 1212 437 1104 -2694 652 27 731 -244 1420 265 -497 -1528 -281 -276 -146 1049 -536 1531 2024 447 965 1262 796 -140 163 35 -29 -326 168 -170 503 732 -1236 -1197 -1484 SS 20210527T094713.5Z 7817.407795 386 1 49.79 2 36.53 141.06 139.85 300.77 0.00 1 0.00 1 0 17 8.025e-03 4.912e-03 4.586e-03 1.840e-03 2.247981e-01 9.711617e-04 2.984006e-03 -6.000000e+00 4.855388e-03 232.05 -2.00 3.88 -2.00 316.78 0.00e+00 2.653583e-05 1.105794e-04 4.496792e-05 -6.000000e+00 1.922485e-04 277.61 -2.00 20.00 -2.00 316.46 0.00e+00 1.244 0.000 302.00 328.00 3 5.5408e+00 2.5620e-03 1.8183e-02 -6.0000e+00 1.2271e-02 4.4337e-02 2.8466e-03 1.2923e-02 -6.0000e+00 1.3295e-02 -3.3291e-03 1.6728e-03 6.3466e-03 -6.0000e+00 7.7893e-03 -7.4171e-04 7.8445e-04 1.7756e-03 -6.0000e+00 3.2022e-03 4.4934e-04 -2.5005e-05 5.7283e-05 2.2841e-05 -6.0000e+00 2.4124e-04 -8.2635e-04 4.0197e-05 10 0 0 10 0 0 99.99 22.33 0.21 -0.00083 -0.00101 34 7 1 5 0 1464.053 25.28 20.00 22.33 19.29 24.6 1004.08 -1074 -1144 -1199 -3431 -1797 -1507 -1671 951 -1727 -1487 -765 653 -2799 -65 59 177 -159 -12 -24 72 747 -86 2275 292 860 81 -118 -401 377 1457 1155 2023 492 29 -885 -749 -1200 61 -131 -629 -433 -679 -454 -895 -619 -1073 -579 -1006 -649 196 387 796 614 803 877 810 194 715 678 796 1159 1120 1382 676 606 97 -67 -258 461 224 394 31 39 -137 -87 -54 -149 -102 -81 -400 -919 -1400 -1342 -920 -1248 -865 -209 -82 481 -93 200 -76 -6 648 296 422 512 614 -161 -68 -83 -440 109 134 -776 -534 -420 -257 31 59 113 25 -28 -292 -231 304 -45 399 174 -282 -387 246 69 370 518 152 873 781 485 400 158 132 200 152 248 -118 253 3 -162 -110 -459 -418 -619 -160 -183 -195 -538 -254 -203 -236 145 -295 -265 -136 117 -565 -14 15 47 -44 -4 -7 22 229 -27 700 95 293 29 -41 -135 119 442 363 670 175 11 -314 -261 -448 26 -65 -354 -264 -433 -296 -591 -407 -705 -373 -633 -400 120 244 526 427 580 649 611 149 546 513 599 889 904 1183 608 546 83 -54 -202 373 197 374 31 39 -133 -80 -46 -117 -76 -62 -329 -834 -1379 -1398 -997 -1425 -1039 -260 -105 616 -117 239 -85 -6 643 301 458 601 775 -214 -91 -107 -534 126 157 -962 -693 -565 -357 44 88 175 39 -43 -429 -318 396 -58 522 239 -408 -576 365 101 525 707 200 1099 972 623 539 222 190 291 227 384 -190 418 4 -275 -185 -757 -672 -977 SS 20210527T104155.8Z 7817.445784 420 1 50.51 2 32.63 162.53 145.94 317.61 0.00 1 0.00 1 0 25 1.085e-02 6.038e-03 9.556e-03 3.600e-03 2.262616e-01 1.900011e-03 3.024401e-03 -6.000000e+00 6.562787e-03 232.06 -2.00 3.88 -2.00 317.01 0.00e+00 3.113729e-04 2.270048e-04 4.699798e-05 -6.000000e+00 2.598351e-04 277.62 -2.00 20.00 -2.00 316.68 0.00e+00 1.187 0.000 302.00 328.00 3 6.3669e+00 5.0238e-03 1.7928e-02 -6.0000e+00 1.6586e-02 6.7346e-02 5.5847e-03 1.3068e-02 -6.0000e+00 1.7970e-02 -7.1889e-03 3.3069e-03 6.4280e-03 -6.0000e+00 1.0528e-02 -3.1294e-04 1.5645e-03 1.8025e-03 -6.0000e+00 4.3283e-03 2.0499e-04 -3.1794e-04 1.1316e-04 2.3288e-05 -6.0000e+00 3.2605e-04 -7.4585e-04 5.5404e-05 10 0 0 10 0 0 99.95 22.33 0.21 -0.00075 -0.00314 36 7 1 5 0 1402.801 25.39 20.00 22.33 20.24 24.5 1007.86 -2311 875 -2689 -1260 0 -607 2004 -4873 110 -3461 -4227 -774 -752 -580 -107 586 -1632 1294 2108 128 1931 391 -718 1188 -41 420 1029 -645 1354 -1100 2675 1501 -385 211 -1006 -499 -2926 -1381 -750 -240 -755 148 -757 -1032 247 -1188 484 -1071 -491 207 1077 320 1025 1299 308 1378 976 853 -153 700 1163 314 946 533 -381 408 -609 -405 702 780 696 -153 422 326 -208 85 -1534 -74 -1122 -714 -1689 -1175 -1696 -858 -292 -371 541 461 1001 -174 -143 -131 -145 82 -125 -74 232 432 105 -37 -269 -678 -558 280 -1457 -14 -552 -12 375 487 380 315 515 -92 19 -780 -910 -13 -560 -518 -362 265 529 328 273 853 511 528 -438 100 834 275 419 301 380 86 461 -13 -272 -86 -390 -539 -776 -326 129 -416 -182 0 -76 255 -729 17 -584 -720 -131 -138 -120 -25 145 -431 343 572 36 550 113 -213 360 -13 138 334 -203 394 -319 772 467 -129 72 -335 -162 -1038 -554 -351 -128 -441 90 -475 -655 155 -751 296 -646 -289 121 644 204 682 899 221 999 720 629 -112 509 860 248 791 469 -339 341 -478 -307 547 667 645 -150 413 311 -189 71 -1177 -53 -824 -568 -1499 -1131 -1746 -918 -329 -443 673 593 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