File name: Pandora21s1_Bremen_20220211_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T100150.9Z 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_20220211_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: 20220211 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 20220211T084933.5Z 8077.367749 250 1 50.01 2 76.25 137.70 100.43 18.79 0.00 1 0.00 1 0 25 3.582e-01 5.822e-03 1.605e-01 2.598e-03 6.866225e-01 1.415288e-03 8.520663e-03 -6.000000e+00 2.115191e-01 223.24 -2.00 3.88 -2.00 321.07 0.00e+00 1.895473e-03 5.328403e-04 7.319373e-04 -6.000000e+00 8.606685e-03 265.83 -2.00 20.00 -2.00 320.76 0.00e+00 4.113 0.001 302.00 328.00 3 2.2713e+00 4.2054e-03 5.6690e-02 -6.0000e+00 5.2386e-01 8.0546e-02 5.7898e-03 4.0110e-02 -6.0000e+00 5.7105e-01 -2.7408e-02 6.8053e-03 2.2743e-02 -6.0000e+00 3.3565e-01 -6.8922e-04 3.4307e-03 7.6958e-03 -6.0000e+00 1.4028e-01 4.1413e-04 -1.0546e-03 7.9058e-05 1.0092e-04 -6.0000e+00 1.0822e-02 -1.4721e-02 1.0901e-05 10 0 0 10 0 0 99.97 22.20 0.15 -0.01472 -0.02265 252 49 1 5 0 198.449 25.17 20.00 22.20 11.20 27.9 1016.70 -105722 -110249 -112987 -116197 187719 -113970 900000 -95563 115061 -114176 -86868 -106286 -64182 -13234 -31317 53286 -51463 53496 -39510 -204 -44470 -7328 -10471 -14645 22945 -16805 12848 -13028 30714 -21290 10102 5617 170 -115 -3921 5771 -1802 17588 -1950 13032 -1484 4621 -2907 -1195 1249 -2991 8396 -4981 9680 -289 3970 -953 3027 1039 35 1287 -1609 1096 -597 4082 242 4046 1249 1883 284 -1144 2432 -124 2506 132 1034 -1006 908 -1238 -1398 590 262 1507 -1097 1013 -907 -763 -2066 -1309 -1603 -1197 -129 -238 1042 -35 1214 625 1522 674 1286 441 276 445 -385 47 -229 239 -168 761 -903 -1025 -618 -454 386 -324 93 -443 10 -115 403 518 209 298 -123 -332 -654 142 -471 290 -26 95 532 794 454 -76 325 -124 269 0 -37 -248 142 157 -307 114 -294 53 -24 -616 -784 -894 -952 476 -879 900000 -756 291 -1292 -845 -1372 -708 -119 -403 400 -1047 505 -869 -3 -1115 -138 -211 -329 409 -440 270 -339 560 -635 266 180 6 -5 -169 230 -82 780 -122 842 -123 395 -280 -117 122 -311 812 -563 1009 -35 513 -143 484 184 7 255 -338 226 -123 792 50 864 307 515 85 -349 714 -38 819 50 426 -447 397 -529 -554 209 87 491 -399 418 -445 -426 -1289 -868 -1129 -890 -100 -190 824 -27 885 431 1000 451 932 366 263 480 -457 57 -269 256 -166 721 -903 -1083 -684 -531 484 -450 141 -725 17 -189 631 778 311 453 -196 -549 -1089 229 -735 435 -37 134 724 1088 676 -127 592 -243 551 0 -83 -591 348 389 -763 277 -686 116 -51 SS 20220211T112745.6Z 8077.477611 337 1 50.14 2 67.07 177.04 87.24 50.68 0.00 1 0.00 1 0 25 6.129e-02 5.151e-03 4.999e-02 3.742e-03 4.248810e-01 1.935598e-03 5.587885e-03 -6.000000e+00 3.595104e-02 223.25 -2.00 3.88 -2.00 319.40 0.00e+00 1.518887e-04 4.646212e-04 2.118436e-04 -6.000000e+00 1.467944e-03 265.84 -2.00 20.00 -2.00 319.11 0.00e+00 2.547 0.000 302.00 328.00 3 4.9010e+00 5.2625e-03 3.4773e-02 -6.0000e+00 8.9028e-02 8.0318e-02 6.0693e-03 2.3840e-02 -6.0000e+00 9.7000e-02 -7.0157e-03 5.0195e-03 1.2372e-02 -6.0000e+00 5.7214e-02 -5.3118e-03 2.7101e-03 3.7937e-03 -6.0000e+00 2.4009e-02 1.7706e-04 -6.2352e-04 1.1735e-04 4.7511e-05 -6.0000e+00 1.8370e-03 -1.5351e-02 4.3371e-05 10 0 0 10 0 0 99.98 22.20 0.11 -0.01535 -0.02004 46 9 1 5 0 1089.892 25.17 20.00 22.20 11.04 28.0 1016.10 29654 989 -11194 16650 15897 49855 -3248 -685 6610 -14618 -18742 594 -1226 1005 -6248 903 -2380 2083 -5122 5687 -4763 -1710 -8152 -4439 -1752 2964 -1364 3671 -2381 7227 4824 2270 836 -4216 -5875 -4004 288 1279 -1529 253 -2537 -72 -2660 -641 -622 -2181 -959 455 660 1214 542 1149 536 845 491 104 407 437 1624 866 1652 1177 892 1610 -66 883 5 753 875 25 276 517 -89 -965 531 -384 60 168 238 533 -781 -1386 -1364 -1266 -597 -1201 83 -388 -49 648 1125 472 588 388 210 377 798 1008 -682 -100 -583 -497 -83 82 -696 -931 -539 -432 648 68 -262 278 467 17 335 118 -9 -253 155 -572 -319 73 -400 -173 267 212 383 714 369 86 309 281 170 124 -112 -120 162 165 -88 -88 -55 -353 -256 513 24 -319 367 332 764 -81 -19 187 -531 -734 21 -50 47 -364 56 -165 148 -412 432 -410 -144 -753 -421 -174 295 -143 358 -237 664 489 263 109 -606 -846 -560 41 209 -306 58 -674 -20 -787 -190 -186 -664 -289 135 198 373 178 407 205 344 210 46 185 199 720 382 737 561 466 903 -39 504 3 407 498 16 192 378 -66 -697 355 -237 34 91 134 334 -561 -1114 -1188 -1165 -577 -1237 89 -430 -54 699 1145 450 525 339 192 378 889 1239 -912 -135 -761 -602 -94 92 -819 -1160 -699 -587 919 104 -428 468 784 27 513 172 -13 -370 236 -917 -522 119 -633 -265 393 300 521 960 523 132 505 479 300 227 -213 -239 333 346 -185 -183 -111 -682 -480 SS 20220211T123552.6Z 8077.524914 378 1 1.76 2 68.12 194.89 78.90 63.09 0.00 1 0.00 1 0 25 5.653e-02 8.698e-03 4.078e-02 6.037e-03 4.360098e-01 3.103104e-03 5.794859e-03 -6.000000e+00 3.316516e-02 223.25 -2.00 3.88 -2.00 318.28 0.00e+00 6.564249e-04 5.551496e-04 1.596191e-04 -6.000000e+00 1.354015e-03 265.84 -2.00 20.00 -2.00 318.00 0.00e+00 2.660 0.000 302.00 328.00 3 3.1651e+00 8.2336e-03 3.5908e-02 -6.0000e+00 8.2130e-02 5.5935e-02 9.2739e-03 2.4259e-02 -6.0000e+00 8.9479e-02 -2.8764e-02 6.5056e-03 1.2347e-02 -6.0000e+00 5.2778e-02 8.1741e-03 3.4741e-03 3.6667e-03 -6.0000e+00 2.2152e-02 9.0754e-04 -3.4630e-04 1.8120e-04 4.4716e-05 -6.0000e+00 1.6943e-03 -1.6780e-02 3.2353e-05 12 9 1 12 1 1 999.00 22.20 0.19 -0.01678 -0.01938 2 19 1 5 0 527.185 25.17 20.00 22.20 11.26 27.9 1017.02 -29290 -6012 -30658 -1884 -22412 -13009 4205 -25642 14013 -9701 14644 -10436 2670 -3795 -120 7676 3915 5121 -192 1673 -3443 5795 -4192 3337 -994 1841 1256 -5655 8512 -227 931 1160 7537 -5852 -3814 -2422 1059 4530 -3339 1288 -1540 -923 114 -734 -1454 -461 -1141 -2045 1881 -453 1375 -630 2201 -695 1272 756 -1230 1123 1221 2579 -998 2273 -88 1419 43 1497 274 1326 1204 -739 -203 -35 191 -845 37 250 -446 389 1136 1293 -1027 -1362 -1958 -1378 -1769 -234 -747 -19 745 -459 433 -536 915 1148 684 625 839 884 -192 -431 41 -472 343 342 -1203 327 -910 -1471 -222 571 -956 -109 -120 -268 5 674 637 -33 665 -518 -1302 82 -164 821 -204 1103 1564 502 825 840 -468 -115 757 994 -170 -81 -295 -236 -312 -494 -48 -242 -394 -1431 -268 -1790 -83 -1115 -578 168 -1485 632 -578 730 -696 181 -321 -12 778 446 616 -26 228 -503 788 -639 504 -166 313 217 -1013 1311 -38 167 231 1555 -1417 -897 -557 250 1180 -1078 457 -612 -386 49 -322 -645 -204 -510 -920 831 -209 656 -325 1177 -398 745 456 -765 689 740 1535 -618 1443 -61 1024 32 1091 195 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