File name: Pandora21s1_Bremen_20210925_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T090843.6Z 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_20210925_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: 20210925 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 20210925T070851.1Z 7938.297814 279 1 50.21 2 74.38 113.68 65.95 265.54 0.00 1 0.00 1 0 25 1.031e-01 7.549e-03 7.921e-02 4.832e-03 4.200258e-01 2.546669e-03 5.430087e-03 -6.000000e+00 6.126184e-02 227.24 -2.00 3.88 -2.00 319.95 0.00e+00 2.078283e-04 6.922674e-04 2.490486e-04 -6.000000e+00 2.469129e-03 278.21 -2.00 20.00 -2.00 319.63 0.00e+00 3.647 0.001 302.00 328.00 3 3.9762e+00 7.1191e-03 4.3452e-02 -6.0000e+00 1.5306e-01 3.0092e-02 8.3120e-03 2.4263e-02 -6.0000e+00 1.6642e-01 2.7543e-02 7.3593e-03 1.2505e-02 -6.0000e+00 9.7870e-02 -2.0720e-02 3.9231e-03 3.8301e-03 -6.0000e+00 4.0633e-02 1.6453e-04 -7.6296e-04 1.5729e-04 4.8884e-05 -6.0000e+00 3.0944e-03 -2.1675e-03 -2.0910e-05 11 8 0 10 0 0 99.97 22.22 0.27 -0.00217 -0.00790 95 19 1 5 0 528.393 25.28 20.00 22.22 23.59 27.3 1018.27 -24275 -30039 -2421 47048 -14347 -3155 -59953 16751 9240 51783 -16665 34094 8691 9232 10982 -18264 15575 -10034 16938 -5355 10343 -4750 9523 2388 3576 8241 -12076 1666 -4709 6364 -4432 13434 -8125 -2100 -4793 586 6343 -9560 1236 -6553 537 -3157 702 -1891 -202 835 -2110 12 -1877 6786 -3310 203 -943 1227 114 679 2255 959 3397 -282 1344 1181 3275 -530 1493 181 79 2251 277 1793 -1213 1432 -351 -298 558 -754 737 -978 2289 -2235 -122 -2296 -1391 -1973 -398 -1208 -478 -190 466 1253 -409 1055 -411 1547 659 431 744 889 -597 -500 853 -882 1191 134 -125 -1084 -973 -6 -87 91 -362 88 -649 386 -467 589 571 281 440 -714 -178 -398 -437 -334 261 421 946 874 409 659 133 184 -298 457 -19 -205 218 112 -564 -313 214 -413 204 -503 -725 -49 612 -295 -58 -1883 310 201 844 -499 718 257 317 430 -1032 714 -612 865 -346 601 -320 586 167 264 613 -1087 130 -377 471 -391 1129 -911 -234 -539 63 695 -1403 196 -1302 111 -723 161 -456 -48 200 -522 3 -472 1627 -932 60 -304 414 41 251 841 364 1244 -106 512 484 1440 -261 744 89 37 1035 139 987 -752 913 -229 -188 327 -410 364 -476 1139 -1303 -79 -1696 -1105 -1672 -353 -1150 -477 -196 479 1246 -390 923 -343 1247 565 410 790 1047 -764 -647 1046 -1019 1269 143 -142 -1318 -1241 -8 -123 137 -588 148 -1093 619 -711 845 806 409 674 -1161 -295 -654 -701 -518 388 601 1297 1197 596 1040 225 326 -549 870 -38 -433 474 249 -1268 -692 456 -851 406 SS 20210925T071415.2Z 7938.301565 282 1 4.90 2 73.64 114.86 66.73 266.62 0.00 1 0.00 1 0 25 6.499e-02 8.558e-03 4.913e-02 5.140e-03 4.096923e-01 2.668990e-03 5.397218e-03 -6.000000e+00 3.863471e-02 227.24 -2.00 3.88 -2.00 318.81 0.00e+00 1.227250e-04 5.425441e-04 1.707845e-04 -6.000000e+00 1.557004e-03 278.21 -2.00 20.00 -2.00 318.51 0.00e+00 3.492 0.001 302.00 328.00 3 3.2214e+00 7.2084e-03 4.1782e-02 -6.0000e+00 9.6525e-02 4.6817e-02 8.1548e-03 2.3458e-02 -6.0000e+00 1.0495e-01 -5.4951e-03 6.1216e-03 1.1812e-02 -6.0000e+00 6.1720e-02 -6.3242e-03 3.2834e-03 3.4763e-03 -6.0000e+00 2.5626e-02 4.1074e-04 -9.5646e-04 1.5879e-04 4.2389e-05 -6.0000e+00 1.9513e-03 -2.2789e-03 -5.2610e-07 12 9 1 12 1 1 99.13 22.22 0.22 -0.00228 -0.00947 5 13 1 5 0 787.896 25.28 19.99 22.22 23.76 27.2 1018.81 7310 -459 -14557 -20135 8464 8049 -19436 22635 -16147 43947 -13750 10878 -8504 11815 -7138 -12432 9103 -712 14918 -9959 3234 -3977 12819 -2894 -885 -6564 -3440 8768 -5472 8104 -3666 9654 -2722 -217 -3268 -1672 -1663 -6891 1239 -3038 -167 -2219 250 459 -2977 -1010 -2168 2339 292 1338 423 1811 -2404 1380 24 1271 841 188 1828 353 2345 1742 2414 1229 989 -149 762 1111 1497 194 -1122 819 -988 1349 -1235 103 1459 230 1009 -1183 -267 -1986 -1054 -2167 -507 -1150 229 -411 -104 643 447 1210 -340 463 -135 919 197 592 -330 -482 20 -1355 400 -396 -355 -1222 -413 -833 -17 542 370 75 -4 224 -362 1272 -44 809 -499 -658 -435 -236 -21 -506 61 104 1482 1165 704 553 133 44 -333 1381 -848 403 -273 279 -263 64 196 -826 -593 198 -15 -558 -790 242 227 -741 664 -743 1266 -687 467 -496 674 -563 -1159 757 -69 1326 -1158 343 -456 1306 -362 -116 -951 -489 1085 -747 991 -539 1400 -484 -39 -601 -302 -322 -1611 318 -934 -55 -792 90 169 -1137 -382 -830 861 111 516 174 790 -1156 680 12 671 455 102 975 189 1264 999 1481 809 669 -99 486 703 993 142 -889 666 -819 1072 -951 73 961 149 675 -881 -218 -1781 -998 -2160 -523 -1247 255 -472 -119 723 483 1234 -334 446 -136 988 231 744 -439 -647 26 -1684 471 -468 -435 -1572 -547 -1145 -24 808 578 120 -6 348 -542 1819 -63 1168 -753 -1030 -690 -373 -32 -770 90 149 2056 1617 1019 846 214 72 -566 2383 -1533 747 -519 537 -509 123 367 -1517 -1067 SS 20210925T071913.7Z 7938.305019 285 1 49.95 2 72.97 115.95 67.44 267.61 0.00 1 0.00 1 0 25 2.243e-02 4.742e-03 6.385e-03 5.709e-04 3.927202e-01 2.968808e-04 5.123694e-03 -6.000000e+00 1.333439e-02 227.24 -2.00 3.88 -2.00 319.37 0.00e+00 5.739069e-04 6.983600e-05 1.917223e-04 -6.000000e+00 5.373627e-04 278.21 -2.00 20.00 -2.00 319.06 0.00e+00 3.362 0.001 302.00 328.00 3 9.9628e-01 8.1529e-04 4.0184e-02 -6.0000e+00 3.3315e-02 1.5011e-02 9.3247e-04 2.2535e-02 -6.0000e+00 3.6222e-02 -4.3119e-03 7.4978e-04 1.1465e-02 -6.0000e+00 2.1302e-02 -5.2843e-03 4.0199e-04 3.4350e-03 -6.0000e+00 8.8450e-03 4.4754e-03 -7.0994e-04 1.8158e-05 4.1670e-05 -6.0000e+00 6.7342e-04 -2.5269e-03 1.4790e-06 10 0 0 10 0 0 98.66 22.22 0.19 -0.00253 -0.00786 812 159 1 5 0 61.358 25.28 20.01 22.22 23.78 27.2 1018.77 -6225 -6037 -8562 -5505 -8945 -3780 -12447 -5825 -8582 -5166 -4696 -2818 -1973 -2334 -232 -3379 71 -1268 606 -830 521 397 -357 -658 -730 -880 -2924 -187 -978 693 59 1154 480 -1672 -679 -1991 -1348 -1409 -912 -1560 -1347 -1253 -1029 -792 -417 -245 -729 -468 -670 543 264 913 782 755 732 664 741 94 899 936 1422 1207 1221 678 212 796 387 960 942 518 -230 98 -292 -64 5 366 445 224 450 -422 -372 -1147 -1430 -1132 -1045 -725 -410 -86 -41 121 366 599 900 1137 933 703 753 286 -307 -518 -321 -406 321 90 -738 -749 -701 -400 -42 -5 -159 -130 -209 1 204 617 542 340 29 -479 -628 -283 -303 -59 202 255 939 1202 645 422 164 86 111 361 -66 -142 56 -2 -358 -195 -200 -222 -9 -158 -159 -241 -145 -246 -96 -367 -181 -283 -176 -165 -104 -84 -118 -14 -231 5 -99 49 -71 45 35 -33 -65 -77 -97 -332 -20 -101 72 7 144 67 -248 -98 -288 -210 -238 -184 -372 -358 -356 -304 -238 -126 -74 -222 -142 -205 169 88 328 303 312 317 298 340 44 407 421 653 596 662 399 129 464 216 528 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