File name: Pandora21s1_Bremen_20210823_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T084908.0Z 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_20210823_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: 20210823 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 20210823T064217.7Z 7905.279372 258 1 50.20 2 69.75 98.18 105.31 268.45 0.00 1 0.00 1 0 25 1.296e-01 9.698e-03 8.971e-02 6.052e-03 3.922592e-01 3.215244e-03 5.086860e-03 -6.000000e+00 7.826195e-02 231.62 -2.00 3.88 -2.00 319.59 0.00e+00 -3.285765e-04 7.778448e-04 1.956431e-04 -6.000000e+00 3.104360e-03 282.00 -2.00 20.00 -2.00 319.26 0.00e+00 2.858 0.000 302.00 328.00 3 5.1314e+00 8.9200e-03 3.6694e-02 -6.0000e+00 1.9757e-01 2.3167e-02 1.0231e-02 2.2937e-02 -6.0000e+00 2.1415e-01 3.0792e-02 8.4178e-03 1.1596e-02 -6.0000e+00 1.2551e-01 -2.0005e-02 4.4897e-03 3.4313e-03 -6.0000e+00 5.1632e-02 1.1095e-04 -8.0501e-04 1.9641e-04 4.2443e-05 -6.0000e+00 3.8952e-03 -2.9127e-04 -1.2754e-06 12 9 8 11 8 0 99.99 22.22 0.13 -0.00029 -0.00634 48 9 1 5 0 1045.730 25.28 20.00 22.22 22.44 26.6 1004.63 10219 30313 18323 111533 -21294 20031 -21597 13555 17840 23486 6458 6951 5031 -28429 48470 -12887 27916 -9906 10611 6127 -965 -7518 -7379 20419 -16821 9057 -14059 15597 7824 3090 11695 3922 6992 -4630 -1910 -13864 4915 3015 6121 -5689 4630 -3165 -2975 -373 -6905 -359 -3717 -794 -2903 3081 2220 3768 29 -1684 4115 -1927 1347 -2753 1995 -697 2809 1809 -1306 1618 -1318 2431 -187 3385 -530 2002 -455 1089 393 593 461 -416 2374 -746 2578 -528 271 -998 -1755 515 -1062 -718 -1520 1204 -1353 188 0 952 395 1186 1190 397 1063 144 108 -716 29 -1448 -452 472 -1095 -583 -1155 387 -752 373 -773 859 -283 396 466 17 497 -416 579 -897 -480 -764 229 430 911 514 650 1466 -505 868 -337 735 -385 205 -291 253 142 -301 350 -601 172 -1038 498 217 602 416 1174 -617 408 -656 343 480 642 210 240 199 -1739 1760 -887 1449 -762 717 450 -78 -652 -662 1521 -1878 837 -1617 1330 692 288 1086 433 822 -633 -250 -2024 651 472 1110 -1347 1106 -867 -846 -106 -2094 -103 -1100 -228 -857 885 684 1238 11 -667 1615 -830 576 -1231 842 -300 1199 834 -676 876 -753 1295 -97 1690 -292 1201 -306 760 278 405 296 -246 1256 -393 1376 -324 187 -774 -1484 452 -1003 -720 -1621 1293 -1495 199 0 879 343 1001 1055 390 1159 176 141 -948 37 -1717 -500 518 -1288 -724 -1510 524 -1087 571 -1273 1440 -476 634 700 24 697 -604 879 -1451 -792 -1256 363 661 1337 727 883 1969 -729 1335 -558 1258 -686 378 -565 514 298 -647 753 -1285 354 -2073 955 SS 20210823T064751.1Z 7905.283230 262 1 50.51 2 68.92 99.34 106.10 269.53 0.00 1 0.00 1 0 17 1.599e-01 1.951e-02 1.635e-01 1.794e-02 3.635232e-01 9.589256e-03 4.750874e-03 -6.000000e+00 9.687887e-02 231.62 -2.00 3.88 -2.00 319.26 0.00e+00 -2.548967e-04 2.106906e-03 1.577063e-04 -6.000000e+00 3.928450e-03 282.00 -2.00 20.00 -2.00 318.93 0.00e+00 2.754 0.000 302.00 328.00 3 6.7003e+00 2.6261e-02 3.4782e-02 -6.0000e+00 2.4490e-01 8.1213e-02 2.9837e-02 2.1224e-02 -6.0000e+00 2.6601e-01 2.2955e-02 2.2835e-02 1.0627e-02 -6.0000e+00 1.5521e-01 -1.1281e-02 1.2139e-02 3.0961e-03 -6.0000e+00 6.4141e-02 2.5727e-05 -3.0460e-03 5.8172e-04 3.8293e-05 -6.0000e+00 4.9511e-03 4.3348e-03 -6.1277e-04 12 9 9 12 1 1 99.96 22.22 1.30 0.00433 -0.01855 14 3 1 5 0 3366.297 25.28 20.00 22.22 22.63 26.7 1005.74 900000 444 98428 900000 -27029 -15764 -37111 900000 -45652 -9556 61220 -34718 10388 -29372 51338 -23961 12486 11143 -1760 -12116 71959 322 -7063 20045 2219 35505 -11743 7173 415 36954 10903 -1473 3333 -332 5176 -11356 17675 -13567 3368 -7134 -4785 10905 -6175 4473 -7006 776 -257 8506 -1069 42 -1462 -410 4820 4644 -447 -4800 -1545 9070 359 -890 5153 2272 6765 3607 -8145 1520 529 -86 -1784 4736 -1596 6835 -549 -1712 -1939 -2556 -1924 -2803 464 -4491 4610 -3874 3052 740 -348 932 -4523 2105 2484 516 -1475 2585 -98 -2633 -2025 1275 883 -243 -1051 631 1218 -4010 -1295 -647 393 -431 -1015 2677 -2342 112 -146 932 -377 -91 -796 1039 166 1721 1486 -1893 40 605 1035 -1081 927 1088 2142 901 -1445 -1191 409 1607 -464 418 197 -204 -442 -787 506 -764 577 845 -1319 900000 15 1721 900000 -1112 -579 -1756 900000 -2872 -462 1634 -2301 521 -2429 2366 -2398 962 918 -171 -1346 3847 33 -804 1896 263 3233 -1648 816 48 3117 1250 -208 490 -52 755 -1930 2487 -2975 749 -2032 -1472 3060 -2109 1403 -2463 254 -84 2554 -353 14 -528 -158 1891 1934 -204 -2355 -750 3985 169 -422 2371 1150 3566 2095 -5385 878 293 -47 -1066 2960 -1157 4798 -415 -1264 -1342 -1622 -1113 -1577 265 -3002 3184 -3218 2559 671 -339 955 -5153 2323 2739 563 -1543 2401 -87 -2342 -1880 1262 978 -300 -1398 830 1521 -4868 -1444 -721 459 -539 -1336 3568 -3460 173 -239 1559 -630 -144 -1188 1439 229 2395 2189 -3036 64 965 1598 -1647 1325 1486 2778 1176 -2034 -1802 649 2622 -795 736 365 -400 -896 -1632 1043 -1569 1128 1585 -2452 SS 20210823T074659.1Z 7905.324295 306 1 1.05 2 60.40 112.34 114.42 281.42 0.00 1 0.00 1 0 17 9.264e-03 5.984e-03 4.867e-03 2.074e-03 2.759515e-01 1.100161e-03 3.678365e-03 -6.000000e+00 5.595550e-03 231.61 -2.00 3.88 -2.00 316.54 0.00e+00 2.308420e-04 1.189852e-04 5.149272e-05 -6.000000e+00 2.219474e-04 282.00 -2.00 20.00 -2.00 316.22 0.00e+00 2.016 0.000 302.00 328.00 3 1.6470e+00 2.8924e-03 2.5733e-02 -6.0000e+00 1.4126e-02 -5.4788e-04 3.2093e-03 1.5883e-02 -6.0000e+00 1.5310e-02 -4.5047e-04 1.8757e-03 7.7834e-03 -6.0000e+00 8.9735e-03 -7.1851e-04 8.7474e-04 2.1744e-03 -6.0000e+00 3.6919e-03 9.8630e-03 -4.0297e-04 6.3710e-05 2.8719e-05 -6.0000e+00 2.7849e-04 -1.6982e-03 -3.1417e-05 12 1 1 12 1 1 72.45 22.22 0.20 -0.00170 -0.00473 11 134 1 5 0 72.817 25.28 20.00 22.22 23.86 26.7 1011.52 -3399 -2763 -2260 -2226 -3239 -1633 -697 413 -401 -487 -2896 -697 -499 100 619 592 1042 -364 619 -93 320 866 929 673 367 -775 -565 -92 781 1448 1102 3096 90 197 -848 185 -827 -830 -330 -940 -779 -1073 -581 -640 -459 -1263 -845 -185 -462 683 437 951 971 418 404 967 1125 731 829 556 1228 1512 1201 221 -341 163 325 169 662 268 -429 -518 -368 -220 -373 253 -66 254 587 -13 -741 -1166 -1345 -1101 -1111 -1140 -319 -275 -182 -20 272 512 962 1141 1296 639 692 -71 -247 -689 -686 -526 366 110 -730 -851 -523 -85 -80 227 -221 -189 -358 113 210 544 831 785 210 -376 -545 -161 -219 354 100 272 1085 961 879 393 86 -25 96 660 99 54 5 -165 -466 -288 -362 -352 -391 -511 -451 -375 -350 -504 -241 -107 70 -71 -90 -556 -136 -108 23 162 171 316 -110 193 -30 106 286 313 239 138 -289 -209 -34 273 495 397 1184 36 81 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