File name: Pandora21s1_Bremen_20210826_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T084913.3Z 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_20210826_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: 20210826 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 20210826T064611.3Z 7908.282076 261 1 20.05 2 69.87 99.83 73.60 252.99 0.00 1 0.00 1 0 25 2.597e-02 5.306e-03 1.743e-02 1.558e-03 4.303148e-01 8.211305e-04 5.602514e-03 -6.000000e+00 1.566441e-02 231.24 -2.00 3.88 -2.00 319.13 0.00e+00 6.062489e-04 1.799762e-04 1.961824e-04 -6.000000e+00 6.221055e-04 281.69 -2.00 20.00 -2.00 318.82 0.00e+00 2.875 0.000 302.00 328.00 3 2.7609e+00 2.2492e-03 3.8263e-02 -6.0000e+00 3.9509e-02 3.3690e-02 2.5551e-03 2.5016e-02 -6.0000e+00 4.2832e-02 -4.4397e-03 2.0120e-03 1.2572e-02 -6.0000e+00 2.5112e-02 -5.0428e-03 1.0777e-03 3.6704e-03 -6.0000e+00 1.0341e-02 1.1081e-03 -7.8744e-04 4.8265e-05 4.3982e-05 -6.0000e+00 7.8048e-04 -1.8447e-03 -4.9693e-06 12 1 1 12 1 1 99.98 22.22 0.15 -0.00184 -0.00776 68 34 1 5 0 288.054 25.28 20.00 22.22 22.03 26.6 1008.89 -6474 -13091 -10850 -3342 -4833 -11784 -7605 -4809 -884 -9935 -1956 -6993 -7250 2016 -3022 966 -2144 -574 -1726 -1673 -2929 -327 -837 1657 -1007 -2864 403 -1507 1746 -1436 1108 -1514 -4 -1072 -2055 813 -1846 368 -1849 -1080 -2861 -1075 -1802 -945 -83 -848 738 -1097 272 94 810 633 1150 761 336 829 597 835 673 1434 951 1557 1299 1100 507 404 853 809 1230 177 103 -624 -85 -273 46 -26 512 881 480 -161 -856 -779 -1523 -963 -1247 -609 -626 -192 -198 -160 553 538 1214 1051 770 632 696 302 -446 -284 -587 -348 93 94 -940 -889 -809 -281 152 16 44 -165 -125 150 417 608 559 372 -99 -513 -830 -195 -457 84 345 265 879 1183 644 438 341 106 229 193 92 -268 59 -87 -262 -223 -323 -179 -98 -156 -365 -310 -90 -123 -313 -207 -143 -27 -359 -68 -277 -336 102 -183 64 -161 -46 -148 -150 -263 -30 -80 166 -107 -325 45 -164 186 -161 132 -201 -1 -165 -314 120 -303 69 -413 -281 -849 -335 -590 -313 -27 -285 245 -371 92 33 301 248 484 343 160 406 301 420 334 701 479 808 743 684 316 252 507 478 773 122 79 -486 -66 -205 33 -17 316 524 302 -111 -680 -670 -1393 -932 -1249 -647 -682 -216 -223 -180 581 539 1129 992 747 662 797 377 -589 -378 -770 -432 107 108 -1152 -1126 -1077 -382 219 24 70 -273 -206 235 627 885 800 549 -151 -806 -1339 -310 -725 128 515 377 1229 1647 931 674 551 181 393 346 171 -512 117 -170 -519 -445 -620 -336 -177 SS 20210826T071518.3Z 7908.302295 283 1 49.82 2 65.62 106.06 77.65 259.00 0.00 1 0.00 1 0 17 1.778e-01 1.153e-02 1.090e-01 7.684e-03 3.615002e-01 4.056307e-03 4.705526e-03 -6.000000e+00 1.071819e-01 231.24 -2.00 3.88 -2.00 319.16 0.00e+00 4.054889e-04 8.675700e-04 1.552486e-04 -6.000000e+00 4.259721e-03 281.69 -2.00 20.00 -2.00 318.84 0.00e+00 2.405 0.000 302.00 328.00 3 5.9660e+00 1.1102e-02 3.2053e-02 -6.0000e+00 2.7032e-01 5.2622e-02 1.2579e-02 2.0957e-02 -6.0000e+00 2.9315e-01 1.6484e-02 9.4753e-03 1.0505e-02 -6.0000e+00 1.7186e-01 -1.2107e-02 5.0284e-03 3.0654e-03 -6.0000e+00 7.0712e-02 7.5819e-05 -1.5410e-03 2.4710e-04 3.7460e-05 -6.0000e+00 5.3468e-03 -1.4748e-04 -1.8870e-04 12 8 8 10 0 0 99.94 22.22 0.55 -0.00015 -0.01173 30 6 1 5 0 1660.432 25.28 20.01 22.22 23.15 26.7 1013.24 21710 17056 -8453 9875 41782 -43670 177682 -32173 19768 -4827 13332 -1597 4760 26103 -27035 17760 -17766 15751 -7158 -77 3437 -8805 10627 -10101 7480 -9061 8581 -3016 37413 3845 5733 5630 1456 3903 5687 18840 -4630 323 -1265 4619 -5263 -2968 -1337 -4119 1730 -6411 3269 -6059 3057 -8387 5030 795 131 1996 682 1634 308 3737 -1510 2941 -116 2798 -259 1847 4724 173 875 -2448 731 -1212 2199 326 1189 -185 -2416 2113 -3041 1808 -1454 -1312 -1324 -86 -1721 -410 -1392 -487 605 439 929 -441 1321 -1039 -420 1036 -894 186 519 1026 -1086 819 -1896 1156 -1044 542 -657 215 26 -316 187 -241 795 -1410 160 -360 349 -86 -167 553 -550 -78 -578 378 -401 409 871 788 867 326 -134 -532 855 -567 631 327 304 -61 495 -59 -18 379 -666 -85 -995 594 535 -342 330 994 -2132 1351 -1668 715 -229 555 -80 255 1341 -2580 1256 -1865 1288 -758 -8 353 -1023 1062 -1295 866 -1276 1029 -389 3209 451 708 768 225 612 858 2498 -824 64 -301 1207 -1673 -979 -450 -1451 580 -2332 1081 -2171 1007 -3155 1761 312 55 879 317 776 151 1781 -746 1385 -58 1447 -150 1121 2847 105 499 -1421 436 -819 1571 250 907 -139 -1730 1324 -1834 1000 -865 -868 -987 -70 -1538 -382 -1391 -514 665 500 1057 -494 1375 -1022 -383 908 -834 188 583 1266 -1459 1090 -2476 1361 -1182 605 -785 270 34 -437 272 -374 1297 -2418 268 -577 521 -121 -232 785 -832 -124 -945 610 -634 621 1263 1095 1157 435 -188 -807 1362 -952 1077 580 566 -120 995 -122 -38 772 -1325 -161 -1858 SS 20210826T073838.2Z 7908.318498 300 1 2.40 2 62.30 111.28 80.95 263.69 0.00 1 0.00 1 0 25 1.155e-02 5.889e-03 3.871e-03 1.241e-03 3.208033e-01 6.554636e-04 4.269019e-03 -6.000000e+00 6.970136e-03 231.24 -2.00 3.88 -2.00 317.13 0.00e+00 3.533131e-04 8.205551e-05 7.439193e-05 -6.000000e+00 2.768026e-04 281.69 -2.00 20.00 -2.00 316.81 0.00e+00 2.140 0.000 302.00 328.00 3 1.3600e+00 1.7336e-03 2.8415e-02 -6.0000e+00 1.7580e-02 9.1825e-03 1.9280e-03 1.8463e-02 -6.0000e+00 1.9058e-02 -5.1188e-03 1.1645e-03 9.0875e-03 -6.0000e+00 1.1174e-02 2.4325e-04 5.6624e-04 2.5537e-03 -6.0000e+00 4.6015e-03 1.0756e-02 -4.7313e-04 3.8159e-05 3.2310e-05 -6.0000e+00 3.4726e-04 -2.1139e-03 2.0883e-06 12 1 1 12 1 1 95.74 22.22 0.25 -0.00211 -0.00567 37 171 1 5 0 57.050 25.28 20.00 22.22 23.19 26.7 1013.73 -208 -3756 -1533 -7458 -415 -5039 -1519 -2154 -928 -1282 -2342 424 -1597 836 -1534 -542 -248 -46 262 -412 -19 612 1966 -819 1133 -484 -176 -317 1576 832 1905 2273 220 -160 -813 356 -526 -215 -300 -1199 -1134 -531 -520 -968 -465 -540 -428 -589 -239 274 639 756 1042 693 497 1049 127 660 770 881 1267 1167 1322 352 43 196 558 585 1154 -43 -382 -382 -558 -395 -417 471 99 636 527 131 -849 -1180 -1467 -1220 -1084 -947 -472 -575 -277 -283 508 316 1067 975 945 825 822 486 -544 -474 -625 -620 242 206 -675 -730 -475 -582 -136 -1 -40 -21 -184 34 448 666 596 621 143 -340 -557 -203 -298 -8 421 366 1005 1103 767 504 401 263 121 293 -153 -114 -72 27 -523 -229 -490 -372 -139 -21 -436 -179 -882 -42 -516 -158 -252 -119 -175 -329 61 -245 145 -314 -122 -56 -11 64 -106 -5 160 520 -235 339 -153 -55 -96 444 235 564 735 74 -56 -277 118 -190 -85 -141 -627 -622 -307 -311 -590 -283 -329 -257 -350 -141 163 398 481 706 474 354 765 96 492 566 642 945 888 1091 299 38 161 450 462 957 -39 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