File name: Pandora21s1_Bremen_20230330_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T135536.8Z 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_20230330_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: 20230330 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 20230330T070618.5Z 8489.296048 237 1 49.65 2 72.69 107.60 100.90 7.03 0.00 1 0.00 1 0 17 2.498e-01 1.171e-02 2.273e-01 9.480e-03 5.103882e-01 5.083121e-03 6.579978e-03 -6.000000e+00 1.495330e-01 226.26 -2.00 3.88 -2.00 320.20 0.00e+00 5.051570e-04 1.498790e-03 3.443049e-04 -6.000000e+00 6.070185e-03 270.15 -2.00 20.00 -2.00 319.90 0.00e+00 3.312 0.001 302.00 328.00 3 5.2851e+00 1.4323e-02 4.4182e-02 -6.0000e+00 3.7278e-01 1.1327e-01 1.7212e-02 2.9420e-02 -6.0000e+00 4.0525e-01 -2.8890e-02 1.6654e-02 1.5551e-02 -6.0000e+00 2.3777e-01 4.2889e-03 8.8267e-03 4.8911e-03 -6.0000e+00 9.9651e-02 5.0803e-05 -1.4494e-03 3.0033e-04 6.2401e-05 -6.0000e+00 7.5483e-03 -3.1469e-02 3.5811e-06 12 8 8 10 0 0 99.97 22.26 0.24 -0.03147 -0.04236 24 5 1 5 0 2067.237 25.28 20.00 22.26 19.74 32.5 1024.00 -113432 900000 -62201 -10879 93880 59732 900000 -45952 152196 13840 -7808 -22729 116543 5136 2765 46400 -1181 24110 -13869 73683 -6967 28227 -29908 17339 -24322 -1087 -6062 5232 6531 26555 23071 -8736 29866 -15902 16498 9528 -993 4634 7349 6399 2222 8233 -6150 -48 -4289 -629 -1344 -4484 -4871 6169 -861 -4055 11222 -1598 8775 -678 520 407 -2007 940 -3843 4463 -3936 1353 765 5027 -3597 -365 -1374 -192 110 18 3142 -3577 2331 184 4150 -2349 -1313 -1 -784 -3152 920 875 -2778 -240 -1736 -297 773 342 -491 2087 3748 778 777 -420 2357 988 314 -242 -845 -748 398 1059 -2076 90 -1645 -367 771 -35 -1177 286 241 99 118 -586 377 -267 914 -1489 -117 514 184 1007 -1123 300 -969 1648 -207 771 479 95 247 -108 486 -894 632 -105 0 -41 -496 -2 -22 -3117 900000 -1359 -155 868 552 900000 -933 1407 205 -145 -514 1077 125 81 1079 -45 804 -683 1803 -350 1062 -1919 782 -1701 -65 -389 300 361 1251 1219 -693 1881 -1623 1255 762 -92 467 860 892 364 1379 -1238 -9 -882 -126 -275 -952 -1062 1259 -201 -1067 2780 -481 2532 -223 174 138 -686 307 -1332 1519 -1596 572 344 2157 -1620 -158 -636 -98 62 11 1849 -2178 1257 93 1841 -1067 -617 0 -472 -2190 675 686 -2388 -214 -1658 -290 755 328 -451 1744 2896 605 635 -384 2372 1131 394 -315 -1071 -877 426 1095 -2300 103 -2021 -469 1037 -52 -1887 477 408 163 185 -875 544 -394 1395 -2438 -194 838 292 1534 -1679 425 -1337 2197 -297 1195 808 170 461 -209 988 -1937 1397 -238 -1 -92 -1082 -3 -43 SS 20230330T075317.3Z 8489.328673 264 1 6.42 2 66.18 118.03 99.53 17.22 0.00 1 0.00 1 0 17 3.838e-02 6.917e-03 3.265e-02 5.208e-03 3.877612e-01 2.710214e-03 5.137417e-03 -6.000000e+00 2.282952e-02 226.26 -2.00 3.88 -2.00 318.19 0.00e+00 3.781793e-04 4.622597e-04 1.346383e-04 -6.000000e+00 9.204945e-04 270.15 -2.00 20.00 -2.00 317.90 0.00e+00 2.458 0.000 302.00 328.00 3 4.4210e+00 7.2051e-03 3.2956e-02 -6.0000e+00 5.6918e-02 7.0281e-02 8.0856e-03 2.1878e-02 -6.0000e+00 6.1832e-02 -2.2635e-02 5.5318e-03 1.1040e-02 -6.0000e+00 3.6392e-02 1.0088e-04 2.9203e-03 3.2427e-03 -6.0000e+00 1.5218e-02 3.2848e-04 -4.8241e-04 1.5907e-04 3.9003e-05 -6.0000e+00 1.1511e-03 -3.2564e-02 4.8554e-05 12 9 1 12 1 1 -67.10 22.28 0.23 -0.03256 -0.03619 3 6 1 5 0 1559.748 25.39 20.00 22.28 20.80 32.2 1027.40 -9576 -11451 16294 1488 -15664 4206 21250 -11815 6452 -10744 -10444 -2587 -8125 1927 5866 1877 -10495 1613 -3046 -1701 -1195 3142 -808 1045 -879 -46 -4175 -112 816 -490 6380 -2645 1616 -747 912 -1580 -54 -886 547 1190 -2467 -613 -837 -1136 -11 -1708 -122 762 215 1315 621 1068 1285 -389 262 2257 1463 961 574 -225 960 886 1016 1468 56 -461 318 -427 939 870 -1071 531 644 -277 242 -748 782 -439 571 976 -272 -1303 -2137 -1074 -1485 -1565 -704 35 269 801 -34 726 -172 692 619 -134 458 1011 29 -520 -1202 112 -73 -267 -724 391 -864 -649 315 306 -249 -293 126 364 669 441 427 67 -87 -203 -248 -108 -171 -186 -180 373 426 1400 1028 202 -34 -443 658 194 -18 -252 -246 713 98 -194 -702 -557 -135 -462 -634 738 76 -871 187 839 -698 359 -751 -753 -183 -676 171 583 219 -1485 217 -450 -259 -186 475 -129 173 -157 -9 -818 -21 143 -87 1124 -556 358 -178 212 -368 -13 -244 174 433 -1022 -265 -376 -521 -5 -794 -56 345 98 605 300 548 697 -225 156 1364 906 601 356 -139 595 575 704 1077 43 -346 228 -303 681 682 -915 469 574 -244 203 -592 570 -311 409 753 -233 -1215 -2131 -1110 -1601 -1765 -820 42 322 942 -39 780 -177 689 632 -146 538 1271 39 -708 -1606 141 -88 -317 -891 499 -1147 -888 444 451 -384 -466 200 562 990 629 596 94 -128 -309 -385 -166 -260 -278 -261 526 583 1885 1428 297 -53 -705 1062 321 -30 -446 -444 1301 180 -356 -1264 -978 -231 SS 20230330T080608.1Z 8489.337594 269 1 24.62 2 64.50 121.03 98.95 19.96 0.00 1 0.00 1 0 25 1.139e-02 4.716e-03 6.073e-03 8.587e-04 3.584935e-01 4.463579e-04 4.762155e-03 -6.000000e+00 6.775489e-03 226.26 -2.00 3.88 -2.00 318.65 0.00e+00 2.969171e-04 8.540480e-05 1.361006e-04 -6.000000e+00 2.731787e-04 270.15 -2.00 20.00 -2.00 318.36 0.00e+00 2.308 0.000 302.00 328.00 3 2.1261e+00 1.1967e-03 3.0791e-02 -6.0000e+00 1.6893e-02 2.8128e-02 1.3496e-03 2.0340e-02 -6.0000e+00 1.8350e-02 2.2144e-03 9.6739e-04 1.0317e-02 -6.0000e+00 1.0800e-02 -8.6363e-03 5.1535e-04 3.0617e-03 -6.0000e+00 4.5168e-03 3.9862e-03 -4.7604e-04 2.6975e-05 3.7551e-05 -6.0000e+00 3.4157e-04 -3.2981e-02 6.2047e-05 12 1 1 12 1 1 100.00 22.28 0.15 -0.03298 -0.03656 510 201 1 5 0 45.677 25.39 20.00 22.28 21.45 32.4 1030.62 -2234 -1028 -443 -3661 493 -3700 -1002 -5818 3915 -3774 1062 -74 488 -964 -1166 -137 -2357 1266 -1581 2041 -719 1733 350 110 -297 -1476 11 -2408 1192 -154 1229 18 751 -292 -1206 193 -1265 -152 -1240 -809 -1843 -744 -1466 -1026 -183 -888 -382 -977 -28 82 928 239 1082 488 763 687 558 910 548 1171 1020 1573 1074 866 85 132 167 211 908 265 196 -221 -122 -307 -13 105 311 387 434 5 -465 -833 -1645 -1055 -1033 -863 -345 -255 -22 -131 531 377 962 1003 1225 680 887 472 -256 -237 -472 -321 -77 342 -629 -705 -566 -435 -97 -86 53 -160 -70 -192 185 323 614 447 176 -277 -572 -105 -347 -28 50 290 483 1094 669 341 321 -143 235 117 73 -158 35 108 -277 -119 -163 -261 -139 -93 -46 -21 -171 21 -160 -44 -282 193 -216 60 -4 33 -77 -104 -14 -261 143 -195 253 -94 223 47 16 -45 -237 2 -384 175 -23 188 3 140 -58 -238 37 -258 -35 -332 -254 -659 -282 -583 -415 -74 -361 -154 -393 -11 33 389 109 525 242 396 368 307 501 299 626 555 902 674 588 60 91 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