File name: Pandora21s1_Bremen_20210620_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T075014.6Z 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_20210620_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: 20210620 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 20210620T065928.8Z 7841.291306 230 1 23.29 2 57.61 93.46 134.55 354.49 0.00 1 0.00 1 0 17 1.543e-02 5.976e-03 1.096e-02 3.100e-03 2.672252e-01 1.638673e-03 3.556344e-03 -6.000000e+00 9.383146e-03 233.67 -2.00 3.88 -2.00 317.57 0.00e+00 -1.252142e-04 2.258137e-04 6.746544e-05 -6.000000e+00 3.696330e-04 280.43 -2.00 20.00 -2.00 317.24 0.00e+00 1.860 0.000 302.00 328.00 3 5.2168e+00 4.3798e-03 2.4457e-02 -6.0000e+00 2.3807e-02 3.5264e-02 4.8712e-03 1.5646e-02 -6.0000e+00 2.5769e-02 4.7708e-03 2.9937e-03 7.6532e-03 -6.0000e+00 1.5079e-02 -4.5983e-03 1.4722e-03 2.1339e-03 -6.0000e+00 6.1728e-03 3.1994e-04 -6.2727e-04 9.7401e-05 2.6805e-05 -6.0000e+00 4.6421e-04 2.6025e-03 -7.6791e-05 12 1 1 12 1 1 99.99 22.61 0.30 0.00260 -0.00211 18 8 1 5 0 1216.251 25.58 20.00 22.61 27.89 25.3 993.77 -7807 -2543 1124 -4042 4323 -7325 4299 -3615 783 -2431 3465 1060 -2282 -1176 -1384 1599 -1185 2589 -2987 94 -935 874 1194 -923 574 -600 662 -2789 2153 -293 1332 791 1200 1286 -490 695 -2961 1415 -2231 -110 -900 -651 -876 -655 -55 -580 197 -1068 -565 -235 548 -503 1813 717 1210 792 12 1182 177 1544 1579 1465 1291 964 212 538 338 -304 1202 -281 -15 -425 336 -770 -96 88 -638 867 -994 -20 -1365 -1024 -1976 -1039 -760 -221 -275 -672 158 -297 198 87 1292 529 810 199 463 1030 -447 -206 -191 -1 -756 -111 -994 -586 -230 -200 525 192 603 -74 142 -620 349 65 442 106 -49 -454 -520 170 -443 113 119 649 499 517 585 579 554 14 573 -139 42 -160 251 218 -331 -47 -334 -397 -517 -780 -262 114 -409 374 -683 379 -382 87 -293 400 130 -318 -184 -245 300 -240 527 -665 21 -216 199 278 -230 149 -162 176 -734 514 -70 330 212 342 375 -141 195 -925 488 -932 -51 -462 -349 -484 -365 -31 -322 108 -577 -301 -126 303 -297 1107 462 799 537 8 812 121 1043 1092 1070 1007 791 176 424 252 -223 911 -236 -13 -400 315 -712 -84 71 -478 613 -732 -16 -1206 -978 -2016 -1099 -843 -258 -335 -843 198 -364 230 95 1303 521 819 216 546 1301 -599 -276 -246 -1 -888 -131 -1241 -764 -310 -279 758 290 943 -118 222 -935 493 87 586 144 -69 -679 -797 259 -667 165 167 879 653 670 784 817 814 21 877 -220 69 -272 438 386 -592 -82 -578 -670 -858 SS 20210620T072327.9Z 7841.307962 248 1 52.89 2 54.03 98.51 134.74 2.47 0.00 1 0.00 1 0 25 7.093e-03 4.777e-03 5.883e-04 1.928e-04 2.466478e-01 1.019319e-04 3.272409e-03 -6.000000e+00 4.315282e-03 233.67 -2.00 3.88 -2.00 317.28 0.00e+00 9.220694e-05 1.307256e-05 5.761264e-05 -6.000000e+00 1.699285e-04 280.43 -2.00 20.00 -2.00 316.95 0.00e+00 1.698 0.000 302.00 328.00 3 8.0117e-01 2.7156e-04 2.2406e-02 -6.0000e+00 1.0949e-02 -3.3852e-03 3.0160e-04 1.4392e-02 -6.0000e+00 1.1850e-02 2.8532e-03 1.8225e-04 7.0313e-03 -6.0000e+00 6.9338e-03 -3.2410e-03 8.8164e-05 1.9552e-03 -6.0000e+00 2.8398e-03 3.2669e-02 -2.2369e-04 6.0338e-06 2.4440e-05 -6.0000e+00 2.1335e-04 1.7610e-03 2.1283e-05 10 0 0 10 0 0 99.98 22.62 0.26 0.00176 0.00008 3074 603 1 5 0 15.921 25.58 20.00 22.62 28.56 25.2 996.88 -2045 -2049 -2517 -2384 -1929 -788 -979 -132 -496 -760 -327 0 -330 -620 -312 -697 -187 -93 201 255 277 788 763 522 232 109 -368 51 730 1051 1108 1329 600 -707 -503 -552 -624 -381 -423 -884 -880 -824 -835 -657 -510 -571 -646 -646 -312 362 501 661 824 723 672 809 727 543 799 955 1175 1265 1131 540 46 219 100 472 722 394 -103 -123 -207 -206 -61 63 194 278 389 -251 -559 -1137 -1368 -1157 -956 -804 -430 -230 -113 -72 236 229 589 871 785 646 766 353 -238 -402 -351 -514 93 64 -595 -515 -576 -396 -12 52 1 -70 -115 -81 88 390 419 360 161 -273 -435 -142 -175 84 310 364 882 999 689 516 301 122 159 333 -44 -90 83 -20 -338 -220 -325 -392 -311 -224 -243 -305 -295 -217 -84 -110 -16 -68 -109 -47 0 -54 -116 -61 -148 -42 -21 48 63 69 197 194 140 66 32 -107 14 205 287 315 374 182 -222 -152 -178 -200 -141 -187 -452 -494 -487 -508 -403 -313 -349 -388 -378 -179 206 298 418 511 471 452 557 509 380 552 655 827 947 913 463 40 178 76 345 552 336 -97 -121 -205 -199 -55 51 144 209 300 -199 -499 -1124 -1359 -1212 -1064 -955 -539 -280 -138 -90 278 247 623 879 819 686 899 458 -310 -526 -466 -634 108 75 -750 -692 -761 -546 -18 80 1 -108 -173 -121 121 537 564 469 223 -406 -670 -219 -264 121 426 508 1166 1301 939 704 435 182 243 525 -69 -148 141 -34 -599 -384 -551 -642 -496 SS 20210620T072818.9Z 7841.311330 251 1 49.86 2 53.31 99.57 134.72 4.09 0.00 1 0.00 1 0 17 2.383e-02 6.964e-03 1.669e-02 4.579e-03 2.561900e-01 2.417462e-03 3.366591e-03 -6.000000e+00 1.450409e-02 233.67 -2.00 3.88 -2.00 317.72 0.00e+00 4.751515e-04 3.442375e-04 6.762166e-05 -6.000000e+00 5.709301e-04 280.43 -2.00 20.00 -2.00 317.39 0.00e+00 1.669 0.000 302.00 328.00 3 6.2079e+00 6.4726e-03 2.2575e-02 -6.0000e+00 3.6802e-02 6.2504e-02 7.2059e-03 1.4891e-02 -6.0000e+00 3.9824e-02 7.4738e-03 4.4506e-03 7.2887e-03 -6.0000e+00 2.3303e-02 -8.0482e-03 2.1936e-03 2.0414e-03 -6.0000e+00 9.5479e-03 1.4281e-04 8.9388e-05 1.4481e-04 2.5175e-05 -6.0000e+00 7.1675e-04 -2.3366e-05 6.5411e-05 11 8 0 10 0 0 99.98 22.63 0.20 -0.00002 0.00065 29 6 1 5 0 1719.179 25.68 19.99 22.63 28.99 25.3 999.97 -4150 10028 -14916 -3570 970 -6027 7002 -7396 1968 -1169 9219 -4297 6083 -1003 -2993 97 -78 218 -755 1497 1682 540 16 983 -694 -54 827 -1568 1397 -3586 3128 -934 1893 906 644 115 2132 1929 -2005 757 -3881 217 -1269 397 -1031 -11 -482 331 8 -1315 901 -184 510 -333 2492 -227 524 441 579 1340 1398 1524 209 1722 -742 638 -1457 -104 386 -228 132 -693 1476 -2 768 -1044 -70 -1243 -1123 -133 -1327 -722 -1345 -453 -664 -122 58 412 260 712 377 -362 722 -86 251 -873 945 836 584 30 -408 -682 -1228 138 -1221 -433 -664 -638 44 203 876 -458 701 -62 86 -444 -566 -365 -475 -231 -311 489 272 604 -120 637 126 1074 435 666 -14 -133 -88 374 191 -143 670 199 362 -243 -598 -583 -641 -397 912 -1748 -357 86 -548 590 -789 211 -135 975 -534 755 -151 -519 18 -15 44 -159 319 366 119 4 230 -174 -14 210 -389 320 -846 722 -241 508 252 173 31 599 626 -796 337 -1974 111 -681 212 -559 -6 -256 170 4 -681 476 -104 304 -209 1573 -150 350 295 382 874 935 1080 161 1376 -609 490 -1068 -73 283 -186 116 -643 1351 -2 649 -822 -50 -849 -786 -101 -1131 -670 -1339 -470 -729 -142 70 517 328 872 437 -390 713 -82 247 -937 1094 1057 782 41 -529 -827 -1426 160 -1515 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