File name: Pandora21s1_Bremen_20201216_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T055920.8Z 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_20201216_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: 20201216 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 20201216T112625.5Z 7655.476684 168 1 49.03 2 76.44 181.38 81.65 157.10 0.00 1 0.00 1 0 25 5.381e-02 4.009e-03 1.840e-02 8.077e-04 4.929308e-01 4.153664e-04 6.335583e-03 -6.000000e+00 3.111377e-02 220.03 -2.00 3.88 -2.00 320.15 0.00e+00 1.089195e-03 1.257422e-04 3.467013e-04 -6.000000e+00 1.289084e-03 267.40 -2.00 20.00 -2.00 319.84 0.00e+00 4.164 0.002 302.00 328.00 3 6.9324e-01 1.1670e-03 4.9203e-02 -6.0000e+00 7.6510e-02 5.6356e-02 1.4076e-03 2.7630e-02 -6.0000e+00 8.3615e-02 -2.3823e-02 1.3750e-03 1.4787e-02 -6.0000e+00 4.9429e-02 -1.0468e-03 7.3134e-04 4.7392e-03 -6.0000e+00 2.0816e-02 2.5231e-03 -7.7011e-04 2.5459e-05 5.9944e-05 -6.0000e+00 1.6127e-03 2.7395e-03 1.3503e-05 10 0 0 10 0 0 98.48 22.10 0.20 0.00274 -0.00305 633 124 1 5 0 76.355 25.17 20.00 22.10 15.46 22.0 1019.47 -23698 -21214 -15864 -8090 -26013 -2960 -25091 -12252 -17842 -10607 -6224 -17645 -8449 -10095 363 -6883 1583 -2741 -169 -1042 -3493 -720 -5070 -1717 -2537 789 -4014 -1163 -1833 -903 -1122 1288 992 -1502 422 -1308 -300 -1863 1010 -1913 -1869 -1466 -2033 -163 -1448 85 -617 203 -429 854 549 1096 883 446 1202 331 801 -166 636 801 1313 1391 1218 736 386 676 -65 763 898 624 -167 -48 107 -331 134 2 457 -165 320 -486 -513 -1219 -1413 -1147 -1057 -664 -368 68 80 331 463 701 844 1156 944 562 930 333 -199 -384 -94 -310 332 76 -754 -675 -636 -305 -118 81 -194 -193 -156 -48 171 454 560 251 18 -517 -378 -64 -119 -71 62 152 619 945 313 202 -35 -21 69 218 -192 -108 159 33 -248 -126 -99 -126 83 -283 -283 -211 -97 -350 -34 -352 -171 -296 -177 -105 -369 -193 -266 10 -247 58 -114 -7 -48 -169 -34 -262 -92 -149 47 -254 -70 -109 -55 -77 99 80 -131 36 -112 -28 -205 131 -301 -330 -277 -405 -33 -297 17 -128 43 -93 191 133 291 256 139 393 114 280 -59 219 273 458 524 510 317 173 318 -30 350 443 324 -96 -29 65 -193 72 1 220 -78 162 -265 -322 -869 -1103 -952 -933 -623 -363 69 82 325 427 600 681 927 814 548 963 390 -254 -497 -115 -350 368 84 -833 -792 -787 -398 -165 123 -303 -316 -257 -76 269 677 824 381 29 -827 -614 -102 -195 -112 94 221 864 1324 475 339 -61 -38 131 433 -383 -228 344 73 -553 -275 -207 -265 168 SS 20201216T113140.6Z 7655.480331 171 1 1.16 2 76.46 182.61 81.35 158.23 0.00 1 0.00 1 0 25 1.687e-01 1.041e-02 1.713e-01 9.045e-03 5.028271e-01 4.609490e-03 6.559439e-03 -6.000000e+00 9.753713e-02 220.03 -2.00 3.88 -2.00 319.31 0.00e+00 1.622160e-03 1.127072e-03 2.665014e-04 -6.000000e+00 4.040692e-03 267.40 -2.00 20.00 -2.00 319.03 0.00e+00 4.172 0.002 302.00 328.00 3 1.8171e+00 1.2479e-02 4.9457e-02 -6.0000e+00 2.3985e-01 8.7019e-02 1.4482e-02 2.7826e-02 -6.0000e+00 2.6211e-01 -2.9417e-02 1.2460e-02 1.4519e-02 -6.0000e+00 1.5495e-01 1.0767e-04 6.7708e-03 4.4962e-03 -6.0000e+00 6.5261e-02 7.8694e-04 -6.7801e-04 2.7034e-04 5.5184e-05 -6.0000e+00 5.0551e-03 1.8537e-03 1.3287e-05 12 9 9 12 1 1 999.00 22.10 0.07 0.00185 -0.00324 2 33 1 5 0 293.927 25.17 20.00 22.10 15.99 22.0 1022.53 -58486 90379 -45516 109978 -29188 7022 -23259 12197 48085 -27557 -3749 -33955 14578 -20459 41207 2970 23684 -1687 31723 1041 3998 32772 -7285 22572 -9783 10803 -19900 -15164 4383 -2681 -5476 -55 10293 -14075 1190 -3816 -613 4037 -5716 -5367 -1738 2270 -6208 1434 -303 -69 -201 2784 2709 -2366 1761 2068 6543 -3015 1877 642 3853 2161 -834 -220 836 2529 -348 629 -88 1852 -3392 192 -304 2516 587 108 -201 -248 1496 -731 2094 527 2215 -2393 -748 -280 -2113 -1369 -2521 -918 -1147 1102 166 128 1110 -237 1815 -774 1857 927 1168 -227 -113 -64 -658 -299 -1288 1279 -1460 -564 -707 27 -544 -67 -227 532 788 -395 -29 301 1414 -837 401 -1203 28 -671 775 382 -880 1401 540 383 461 419 23 -867 415 291 204 -152 196 248 -10 -131 -401 -583 -22 -1584 808 -1306 970 -681 120 -540 234 756 -864 -101 -1292 431 -976 1377 157 1150 -110 1644 74 283 1828 -596 1518 -933 901 -2199 -1578 379 -257 -597 -6 1233 -2198 161 -538 -90 660 -1201 -1298 -451 606 -1852 410 -89 -20 -61 828 827 -785 604 765 2504 -1322 826 294 1758 1001 -390 -102 392 1247 -190 367 -53 1090 -2030 113 -189 1678 425 82 -153 -182 1028 -476 1258 316 1387 -1714 -586 -238 -1938 -1305 -2526 -951 -1232 1192 181 137 1133 -232 1691 -733 1816 988 1353 -287 -150 -85 -857 -367 -1519 1475 -1776 -710 -920 36 -768 -100 -356 854 1265 -625 -44 444 2053 -1254 617 -1923 44 -1069 1200 581 -1315 2015 764 546 688 665 38 -1506 734 529 384 -296 388 497 -21 -261 -778 -1101 -40 SS 20201216T114955.2Z 7655.493000 180 1 50.40 2 76.69 186.91 80.45 162.16 0.00 1 0.00 1 0 25 2.545e-01 1.002e-02 1.852e-01 7.149e-03 4.961832e-01 3.729279e-03 6.442090e-03 -6.000000e+00 1.471053e-01 220.03 -2.00 3.88 -2.00 320.38 0.00e+00 1.206663e-03 1.166108e-03 3.562390e-04 -6.000000e+00 6.097119e-03 267.40 -2.00 20.00 -2.00 320.07 0.00e+00 4.239 0.002 302.00 328.00 3 3.7741e+00 1.0554e-02 5.0008e-02 -6.0000e+00 3.6173e-01 9.6135e-02 1.2786e-02 2.7993e-02 -6.0000e+00 3.9540e-01 -1.3497e-02 1.2517e-02 1.4954e-02 -6.0000e+00 2.3374e-01 -2.0344e-03 6.6284e-03 4.7947e-03 -6.0000e+00 9.8383e-02 1.0391e-04 -1.6367e-03 2.2922e-04 6.5217e-05 -6.0000e+00 7.6315e-03 3.7673e-03 -1.0366e-04 12 8 8 10 0 0 99.99 22.11 0.14 0.00377 -0.00853 99 19 1 5 0 503.908 25.17 20.00 22.11 15.69 21.6 1018.11 -118478 -43997 -40940 45226 -5523 137748 5656 -17011 -73800 -56021 127651 -15818 42056 -31169 77387 25258 68428 35639 11465 9800 -10349 49463 -8821 14258 -20667 19843 -6151 43100 25534 -21556 27162 5312 5638 -16056 4883 2696 5230 -13639 3195 4375 -5122 -2102 -2155 1302 -5097 5999 -3047 991 -6391 3624 2154 163 3892 -2382 3265 -1229 5390 -1030 1678 -799 5014 3913 1856 2040 -3881 1067 -2039 5751 285 143 2346 518 -50 996 2485 -2163 550 -2197 721 -2406 1164 -1425 -1425 -1030 -2806 -195 -1697 94 -236 607 555 1769 1057 1853 411 -855 1335 6 602 -1222 285 -89 662 9 -1533 -856 -1091 -31 425 119 28 35 198 -256 598 -417 287 -253 706 -1157 -328 -523 -360 361 -204 683 1203 1265 174 642 4 284 45 312 -351 -81 357 100 -304 -61 34 -538 -138 -3625 -836 -795 437 -76 960 75 -296 -2198 -1544 890 -362 705 -1097 1352 748 1573 1135 468 422 -539 1610 -475 676 -1394 1001 -389 1788 1205 -1553 1438 380 444 -1603 403 227 462 -1636 391 615 -872 -372 -398 239 -1003 1082 -604 191 -1357 734 476 40 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