File name: Pandora21s1_Bremen_20220130_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T095818.3Z 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_20220130_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: 20220130 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 20220130T090736.1Z 8065.380279 118 1 49.88 2 77.79 143.48 80.90 169.75 0.00 1 0.00 1 0 25 1.511e-01 4.089e-03 5.938e-02 1.467e-03 6.003357e-01 7.841693e-04 7.559887e-03 -6.000000e+00 8.835458e-02 222.42 -2.00 3.88 -2.00 320.74 0.00e+00 2.287209e-03 2.741928e-04 5.562661e-04 -6.000000e+00 3.619705e-03 265.79 -2.00 20.00 -2.00 320.44 0.00e+00 4.591 0.002 302.00 328.00 3 1.1827e+00 2.2813e-03 5.6643e-02 -6.0000e+00 2.1840e-01 1.0663e-01 2.9426e-03 3.4623e-02 -6.0000e+00 2.3811e-01 -4.9675e-02 3.2612e-03 1.9119e-02 -6.0000e+00 1.4053e-01 6.2142e-03 1.6844e-03 6.3417e-03 -6.0000e+00 5.9053e-02 8.8476e-04 -7.6062e-04 4.5484e-05 8.2809e-05 -6.0000e+00 4.5296e-03 -1.3961e-02 2.4098e-05 10 0 0 10 0 0 99.68 22.20 0.20 -0.01396 -0.01968 310 61 1 5 0 160.889 25.28 20.00 22.20 12.99 27.6 1014.65 -23285 -66642 -19540 -68564 -31677 -49854 -61729 -60030 -53890 -36501 -44805 -468 -35290 -16269 -26103 -20850 -13829 -11671 787 -8847 10012 -7002 9594 -11791 3314 -4519 -8115 -3879 -5598 -2682 -9540 7362 -2768 3386 -8192 831 -1123 -1083 1166 -2750 72 -1334 1346 -1496 1141 -1355 1159 380 -273 1263 318 1249 614 1426 -239 848 108 91 486 784 1527 790 1995 674 905 10 977 880 1093 738 -37 50 -291 545 2 32 -668 178 168 -594 -284 -778 -1346 -1434 -1038 -1062 -437 -197 368 479 455 944 820 1056 430 1058 494 467 -280 -277 -36 -281 471 378 -343 -919 -456 -310 100 -248 -326 -264 -295 -80 13 548 493 449 238 -176 -375 -38 -115 -122 203 -71 629 796 424 -9 36 -52 -44 311 -151 -147 33 107 -258 13 -129 -173 203 -118 -564 -122 -637 -210 -389 -530 -572 -546 -339 -486 -4 -484 -235 -480 -436 -307 -281 18 -238 231 -195 235 -387 101 -159 -302 -137 -200 -98 -400 308 -148 183 -497 46 -68 -77 99 -269 8 -159 165 -195 148 -183 156 53 -40 194 54 233 127 317 -58 211 28 24 123 195 386 218 609 232 331 4 350 321 429 329 -17 25 -144 274 1 14 -262 68 70 -288 -160 -470 -903 -1031 -792 -863 -372 -173 323 408 365 705 582 750 332 923 498 535 -333 -338 -42 -320 488 382 -365 -1045 -545 -393 129 -354 -511 -440 -502 -131 20 812 720 673 376 -293 -631 -62 -182 -186 298 -101 851 1084 628 -15 66 -97 -85 637 -329 -339 78 258 -629 31 -295 -371 417 SS 20220130T091156.6Z 8065.383294 121 1 3.55 2 77.40 144.47 80.79 170.69 0.00 1 0.00 1 0 25 1.244e-01 5.371e-03 8.371e-02 3.232e-03 5.866660e-01 1.679330e-03 7.485049e-03 -6.000000e+00 7.276864e-02 222.42 -2.00 3.88 -2.00 319.95 0.00e+00 2.490028e-03 4.895489e-04 3.988626e-04 -6.000000e+00 2.980225e-03 265.79 -2.00 20.00 -2.00 319.68 0.00e+00 4.461 0.002 302.00 328.00 3 9.8651e-01 4.6555e-03 5.4840e-02 -6.0000e+00 1.7988e-01 1.0935e-01 5.6123e-03 3.3003e-02 -6.0000e+00 1.9608e-01 -6.1264e-02 5.5241e-03 1.7495e-02 -6.0000e+00 1.1572e-01 1.4011e-02 2.9498e-03 5.5290e-03 -6.0000e+00 4.8652e-02 1.2326e-03 -3.7098e-04 9.4562e-05 6.8521e-05 -6.0000e+00 3.7282e-03 -1.4944e-02 1.1478e-04 12 1 1 12 1 1 72.66 22.21 0.19 -0.01494 -0.01773 23 70 1 5 0 140.761 25.28 19.99 22.21 13.00 27.7 1015.54 -32829 -43926 -23371 -6685 -52214 -20223 -68500 14123 -58740 -5084 -40958 -44179 -19315 -24683 -16094 -10102 12282 -14124 4634 -7185 7777 -5419 1666 1613 -10405 407 -7873 289 -8876 2422 -7979 -1129 -427 -1112 1336 -4632 1124 -4644 3369 -2863 718 -1973 -291 631 -1331 -639 -2087 1656 -969 2142 543 2038 1350 585 939 449 60 -8 1586 197 3614 1288 2141 -266 410 71 506 1525 630 714 299 137 -473 211 72 316 151 458 -69 -1381 194 -895 -1374 -1498 -1305 -799 -317 -293 -193 750 1068 888 -136 745 453 480 377 408 61 -85 -688 -117 482 208 -336 -1174 -636 120 -343 73 -352 28 -409 -89 -161 403 848 426 68 -359 29 -145 95 85 88 61 328 939 341 177 -301 -220 151 559 -140 -168 345 -66 65 -674 -73 -169 90 -328 -533 -270 -65 -696 -207 -1113 122 -1097 -65 -745 -932 -389 -664 -460 -325 359 -595 175 -324 312 -251 75 78 -571 21 -455 15 -507 140 -545 -85 -37 -104 121 -443 109 -523 425 -457 126 -363 -55 123 -270 -131 -443 347 -217 492 138 568 416 186 316 158 22 -3 560 69 1261 497 917 -123 200 35 241 726 327 417 184 90 -313 132 44 175 78 230 -37 -878 134 -679 -1156 -1290 -1193 -774 -308 -294 -194 729 1021 793 -122 662 415 478 413 507 80 -115 -895 -145 542 238 -388 -1455 -794 158 -470 106 -543 46 -683 -144 -257 608 1251 648 109 -584 47 -234 153 132 132 90 470 1347 512 286 -520 -393 281 1058 -284 -348 736 -140 138 -1409 -150 -338 172 SS 20220130T091608.7Z 8065.386212 123 1 49.85 2 77.04 145.42 80.69 171.60 0.00 1 0.00 1 0 17 3.557e-01 9.188e-03 2.311e-01 7.617e-03 5.657461e-01 4.109678e-03 7.164400e-03 -6.000000e+00 2.102015e-01 222.42 -2.00 3.88 -2.00 320.68 0.00e+00 2.380495e-03 1.389420e-03 4.829933e-04 -6.000000e+00 8.855276e-03 265.79 -2.00 20.00 -2.00 320.37 0.00e+00 4.345 0.002 302.00 328.00 3 3.7628e+00 1.1841e-02 5.3424e-02 -6.0000e+00 5.2071e-01 1.1512e-01 1.4878e-02 3.2347e-02 -6.0000e+00 5.6862e-01 -1.5644e-02 1.5783e-02 1.7620e-02 -6.0000e+00 3.3323e-01 -4.0919e-03 8.2325e-03 5.7715e-03 -6.0000e+00 1.4080e-01 8.5471e-05 -1.1284e-03 2.4340e-04 7.6504e-05 -6.0000e+00 1.0832e-02 -1.2898e-02 -6.6175e-05 11 8 0 10 0 0 99.99 22.21 0.11 -0.01290 -0.02138 80 16 1 5 0 623.071 25.28 20.00 22.21 13.03 27.8 1016.35 -129998 900000 900000 -17081 154339 -11528 900000 93765 900000 -85334 305267 16249 58969 42429 -28144 -6729 -1223 -21557 -7683 24035 -14675 26121 -12559 11992 -4407 7788 35988 -16362 37411 -22081 51591 324 13487 -20366 -11695 8647 6791 10986 -13997 6723 3261 5627 -9945 -6660 -59 -1854 -4452 -6528 4852 -385 3548 -1429 1129 3368 1226 3083 942 546 -5559 5633 -2638 2441 -1333 2610 -385 2385 2733 1767 3777 -457 2023 -52 387 1422 986 996 2947 -802 424 327 -1295 -458 -4310 -1115 -2077 210 -1335 -556 532 74 1390 502 1313 1564 832 238 1726 354 -1042 766 -1235 -80 307 729 -386 382 -1572 -462 -226 -332 64 -273 -559 -302 -7 763 560 -60 27 -305 -1286 832 216 741 -103 209 35 324 312 276 589 -180 400 414 309 -1064 470 128 113 -159 -361 -8 -322 -2523 900000 900000 -165 1146 -100 900000 696 900000 -1814 2266 181 548 542 -740 -172 -33 -742 -253 644 -551 718 -485 404 -181 304 1140 -782 1155 -1150 1651 18 749 -1600 -851 529 450 805 -1502 702 393 714 -1522 -1019 -9 -281 -705 -1076 748 -66 630 -292 245 772 303 779 250 146 -1547 1397 -723 686 -431 897 -144 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