File name: Pandora21s1_Bremen_20220925_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T123151.9Z 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_20220925_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: 20220925 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 20220925T064544.1Z 8303.281761 104 1 50.29 2 77.54 108.67 69.94 109.36 0.00 1 0.00 1 0 25 2.896e-01 9.441e-03 2.996e-01 8.324e-03 6.225093e-01 4.624127e-03 7.778673e-03 -6.000000e+00 1.734055e-01 227.25 -2.00 3.88 -2.00 320.96 0.00e+00 2.191069e-03 1.659825e-03 6.062570e-04 -6.000000e+00 7.373514e-03 278.21 -2.00 20.00 -2.00 320.65 0.00e+00 4.505 0.002 302.00 328.00 3 3.9383e+00 1.3641e-02 5.7708e-02 -6.0000e+00 4.3382e-01 1.4198e-01 1.8045e-02 3.6946e-02 -6.0000e+00 4.7191e-01 -7.5445e-02 2.0303e-02 2.0441e-02 -6.0000e+00 2.7760e-01 2.1424e-02 1.0347e-02 6.7499e-03 -6.0000e+00 1.1688e-01 5.6370e-05 -9.4719e-04 2.6330e-04 8.7677e-05 -6.0000e+00 8.7554e-03 -2.1784e-02 1.1099e-04 12 8 8 10 0 0 75.12 22.06 0.36 -0.02178 -0.02890 22 4 1 5 0 2285.582 25.17 19.99 22.06 18.33 29.8 1003.49 900000 -69425 900000 163231 -49761 100728 -75640 -11607 -62430 -89684 -108938 900000 -110187 792 73922 8893 54674 10616 900000 11316 -20985 -35702 -19131 -32845 -6804 -35574 -39349 -28656 -64043 34342 -21094 13430 14763 30935 -17977 3472 6670 18729 -8658 -12344 8925 -6359 12982 -5086 10028 -2624 -1019 -2593 -2482 11735 -7136 7622 -5558 8192 3481 12931 1886 3667 1788 -4997 903 1449 865 -383 5766 258 -1055 3203 879 -101 2050 -433 -46 1386 -2635 3330 -3231 80 778 -389 1566 -2186 869 -1759 357 -1438 -840 411 907 650 930 1882 -431 1178 1243 1569 -458 -48 -837 -1068 -101 96 -493 -658 -876 -1165 -1146 -1095 -526 349 -127 53 -413 374 840 611 -72 537 -56 -1027 -573 -252 359 -594 836 224 1303 1514 790 198 213 506 -236 554 -160 -71 75 -133 -459 174 -211 -499 104 900000 -563 900000 1324 -404 817 -614 -94 -563 -1126 -1736 900000 -2366 8 600 120 552 175 900000 212 -544 -1073 -514 -1067 -189 -1354 -1588 -1043 -3190 743 -848 463 574 1126 -1023 162 322 933 -663 -1160 781 -697 1253 -601 1048 -315 -123 -327 -326 1430 -1133 1166 -1059 1486 703 2500 418 806 394 -1158 201 345 231 -115 1751 83 -338 999 301 -40 867 -199 -21 609 -1119 1217 -1162 27 284 -165 756 -1246 532 -1183 250 -1088 -666 333 738 518 701 1317 -294 789 893 1270 -432 -51 -984 -1296 -118 102 -488 -632 -878 -1240 -1284 -1297 -667 480 -192 86 -683 603 1289 897 -105 794 -87 -1683 -948 -407 558 -903 1208 314 1751 2036 1149 321 378 957 -471 1152 -354 -164 179 -324 -1128 417 -488 -1097 218 SS 20220925T065700.3Z 8303.289587 107 1 26.98 2 75.95 111.06 68.43 111.80 0.00 1 0.00 1 0 25 2.004e-01 9.165e-03 2.450e-01 7.295e-03 5.539255e-01 3.914695e-03 7.043222e-03 -6.000000e+00 1.201966e-01 227.24 -2.00 3.88 -2.00 320.39 0.00e+00 2.522939e-03 1.241913e-03 4.240207e-04 -6.000000e+00 4.803284e-03 278.21 -2.00 20.00 -2.00 320.10 0.00e+00 4.028 0.001 302.00 328.00 3 4.2092e+00 1.1167e-02 5.1316e-02 -6.0000e+00 3.0074e-01 1.0195e-01 1.3785e-02 3.2281e-02 -6.0000e+00 3.2684e-01 -3.5797e-02 1.4228e-02 1.7188e-02 -6.0000e+00 1.9149e-01 7.6983e-03 7.4561e-03 5.4475e-03 -6.0000e+00 7.9432e-02 7.3365e-05 -7.2424e-04 2.2794e-04 6.8870e-05 -6.0000e+00 6.0997e-03 -2.0772e-02 3.4964e-05 12 9 1 12 1 1 95.80 22.06 0.16 -0.02077 -0.02621 7 3 1 5 0 3350.239 25.17 20.00 22.06 18.65 29.7 1005.53 35904 -47797 -68407 -34837 -5832 28889 -116577 900000 -65491 43463 -41861 20163 82709 -29315 -47866 -47922 17043 -22682 36370 11053 -7400 11417 -30570 65811 -16806 5452 -11406 -5010 -1252 23091 -7247 9073 2643 -1298 -293 11024 1262 -10486 8009 4183 -1331 -9062 -2137 2795 -3847 -7493 -6755 1743 2025 1573 3897 4824 1800 3308 1077 -3479 5909 -1659 3102 -2140 6691 125 2392 6340 1553 2300 -1994 170 -1392 2628 -794 954 -1578 1270 -1006 -1645 1035 -249 2476 -3438 852 -893 -1706 -1238 -280 967 223 508 -512 537 -147 1829 -1967 -153 1701 802 507 -259 220 -1726 191 770 -334 370 -1216 -1095 -1064 -409 -680 33 -316 161 243 -419 1208 1047 -22 -646 -231 -360 -431 -380 -862 875 1172 -105 914 1245 278 776 488 470 -130 -96 -343 104 23 -50 209 -252 -577 -343 126 255 -519 -955 -362 -45 205 -2423 900000 -1072 309 -635 196 588 -633 -1478 -1734 386 -801 815 327 -267 353 -1430 1380 -793 222 -552 -226 -54 833 -386 482 169 -92 -21 695 93 -999 768 492 -186 -1476 -343 442 -660 -1356 -1237 300 360 295 774 1045 438 855 301 -1058 1691 -513 905 -649 1904 41 843 2374 643 941 -828 69 -617 1255 -431 539 -919 696 -527 -793 450 -107 1104 -1837 502 -602 -1266 -973 -230 836 204 478 -490 498 -131 1496 -1580 -120 1394 738 526 -302 276 -2254 237 885 -361 389 -1349 -1281 -1301 -523 -926 48 -499 267 406 -689 1872 1555 -32 -977 -363 -590 -718 -625 -1383 1344 1738 -152 1273 1728 413 1251 849 863 -248 -192 -715 226 51 -113 476 -567 -1259 -717 254 SS 20220925T070641.8Z 8303.296318 110 1 4.67 2 74.61 113.14 67.15 113.94 0.00 1 0.00 1 0 25 8.646e-02 6.397e-03 7.160e-02 3.876e-03 5.215494e-01 2.034904e-03 6.770557e-03 -6.000000e+00 5.152970e-02 227.24 -2.00 3.88 -2.00 319.53 0.00e+00 7.222785e-04 5.164565e-04 2.913492e-04 -6.000000e+00 2.071592e-03 278.21 -2.00 20.00 -2.00 319.24 0.00e+00 3.698 0.001 302.00 328.00 3 2.3625e+00 5.6042e-03 4.7458e-02 -6.0000e+00 1.2876e-01 4.7990e-02 6.5228e-03 2.9978e-02 -6.0000e+00 1.3985e-01 -2.6233e-02 5.8025e-03 1.5476e-02 -6.0000e+00 8.2251e-02 3.2872e-03 3.1233e-03 4.7039e-03 -6.0000e+00 3.4271e-02 6.8422e-04 -8.5474e-04 1.1688e-04 5.6578e-05 -6.0000e+00 2.5935e-03 -2.2815e-02 1.5630e-05 12 1 1 12 1 1 58.47 22.05 0.21 -0.02282 -0.02924 11 26 1 5 0 373.939 25.17 20.00 22.05 18.80 29.7 1006.00 -27937 -482 -59296 25426 -34120 -33320 -14781 -18617 -19988 -710 -11088 -17490 -21455 -1223 -1315 -17158 3240 7167 9549 4222 -2011 8761 -6775 -3085 -9523 -6984 -6478 -6194 -4085 94 6309 -8793 -1170 -7118 1815 -1880 -641 -418 -931 -702 -1859 1299 660 1193 -709 -463 -834 -290 451 431 616 1393 1874 2353 1661 450 -553 549 679 1426 1460 2359 1667 1627 -249 760 165 1220 1584 -1035 -1405 -652 104 -1165 633 206 422 -23 532 -579 -421 -465 -1802 -605 -1679 -937 -476 -112 -104 -155 596 515 1135 1666 894 391 803 14 -14 -752 -56 77 172 291 -902 -1203 -672 -329 -368 199 402 134 226 200 173 797 363 233 219 -651 -1085 -349 -732 170 -140 587 381 1192 596 573 141 42 67 260 10 -220 44 248 -411 -522 -319 53 194 -411 -7 -1416 288 -623 -588 -243 -340 -420 -13 -247 -455 -653 -37 -49 -840 145 337 473 233 -122 487 -456 -215 -769 -583 -550 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