File name: Pandora21s1_Bremen_20210322_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T064539.2Z 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_20210322_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: 20210322 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 20210322T080401.9Z 7751.336133 225 1 49.72 2 67.59 121.66 98.66 26.04 0.00 1 0.00 1 0 25 5.227e-02 5.411e-03 5.075e-02 4.592e-03 4.051047e-01 2.382284e-03 5.273292e-03 -6.000000e+00 3.086663e-02 225.59 -2.00 3.88 -2.00 319.40 0.00e+00 1.012230e-03 5.648225e-04 1.992039e-04 -6.000000e+00 1.252454e-03 269.14 -2.00 20.00 -2.00 319.10 0.00e+00 2.601 0.000 302.00 328.00 3 5.0749e+00 6.5056e-03 3.4628e-02 -6.0000e+00 7.6822e-02 6.8365e-02 7.4711e-03 2.2895e-02 -6.0000e+00 8.3647e-02 -9.2060e-04 6.0269e-03 1.1749e-02 -6.0000e+00 4.9253e-02 -6.2443e-03 3.2349e-03 3.5511e-03 -6.0000e+00 2.0502e-02 1.4492e-04 -4.4789e-04 1.4583e-04 4.4286e-05 -6.0000e+00 1.5692e-03 2.6794e-03 -2.3948e-05 10 0 0 10 0 0 99.98 22.36 0.15 0.00268 -0.00069 49 10 1 5 0 1014.504 25.39 20.00 22.36 12.60 23.1 1025.54 1166 -23860 -495 -20118 8182 -30105 6279 5836 -9713 20288 -3666 19663 14334 9539 -6004 2257 -4746 217 -2211 3829 6049 6923 258 -1917 -3839 -6925 -4125 -2236 1722 9958 -2693 -1420 2852 -2790 -3072 2410 306 -2669 -4462 -390 532 -944 734 -2097 -2343 -3191 950 563 -798 1069 727 1567 860 133 375 2228 720 1277 755 1329 1060 -177 425 256 731 -444 434 -271 1346 1347 -195 486 -324 488 907 831 -985 144 -707 -628 -72 -868 -1422 -1668 -1086 -960 -334 247 320 -240 1294 544 259 705 -329 137 812 471 -204 -283 -154 35 -59 393 -797 -1068 -452 35 412 -30 280 232 -133 -203 -356 618 -75 201 -181 5 -242 -129 211 -299 -280 54 660 863 406 173 56 -303 436 28 -117 263 290 0 -487 122 -475 60 -106 29 -812 -14 -667 201 -1001 162 167 -348 596 -137 642 558 454 -381 149 -361 17 -184 314 499 572 23 -188 -407 -787 -459 -237 171 933 -308 -179 379 -407 -440 327 46 -475 -961 -94 141 -269 214 -640 -722 -999 286 170 -247 335 243 563 334 55 162 975 326 575 337 586 481 -87 227 148 429 -254 236 -147 768 856 -137 355 -238 344 596 499 -554 78 -405 -403 -52 -699 -1242 -1543 -1058 -992 -360 273 355 -260 1302 512 229 611 -304 139 911 585 -272 -379 -197 41 -66 437 -945 -1341 -591 48 592 -46 458 391 -223 -327 -540 883 -106 292 -277 8 -395 -208 332 -457 -410 76 889 1160 580 267 93 -520 765 51 -225 526 597 0 -1029 252 -954 116 -199 SS 20210322T082842.6Z 7751.353271 240 1 1.21 2 64.53 127.53 96.96 31.18 0.00 1 0.00 1 0 25 3.440e-02 8.658e-03 2.053e-02 5.278e-03 3.580623e-01 2.726989e-03 4.791802e-03 -6.000000e+00 2.031117e-02 225.59 -2.00 3.88 -2.00 317.47 0.00e+00 6.550819e-04 3.843288e-04 9.681389e-05 -6.000000e+00 8.241118e-04 269.14 -2.00 20.00 -2.00 317.17 0.00e+00 2.311 0.000 302.00 328.00 3 2.9369e+00 7.1631e-03 3.0629e-02 -6.0000e+00 5.0552e-02 3.7930e-02 8.0136e-03 2.0101e-02 -6.0000e+00 5.5041e-02 -1.6478e-02 5.0075e-03 1.0087e-02 -6.0000e+00 3.2409e-02 2.6826e-03 2.5337e-03 2.9212e-03 -6.0000e+00 1.3492e-02 1.7778e-03 -6.3038e-04 1.5999e-04 3.6723e-05 -6.0000e+00 1.0325e-03 1.8780e-03 -3.6598e-05 12 9 1 12 1 1 999.00 22.36 0.29 0.00188 -0.00286 2 28 1 5 0 344.381 25.39 20.00 22.36 13.30 23.1 1027.83 -14574 18127 -10256 124 -10843 6584 2813 -6011 12184 -8757 9720 -12330 -1019 -7354 -552 -2421 148 993 -1143 583 -1891 5502 -1268 3895 485 1345 -88 769 2806 -2406 2142 -709 5107 -5441 -543 -1762 -1161 848 -2139 -1381 -873 172 -1719 -1009 -592 630 -488 945 428 509 1834 -551 3421 376 1500 -720 460 1311 776 1557 1210 1642 695 928 49 499 -603 601 194 -204 -233 -535 53 -1299 1369 -225 162 933 314 820 -777 -1998 -2238 -881 -1538 -1385 -1561 -936 -182 -516 830 -201 1217 1241 1551 984 1220 622 -351 -456 -478 -341 760 917 -843 -607 -1227 -132 -342 438 61 -11 545 -311 330 706 238 130 450 -124 -373 -216 -509 -123 -258 819 923 848 685 995 -645 -715 232 352 341 -73 339 159 -600 -787 -149 -145 -71 -1293 1322 -992 11 -947 479 223 -571 1081 -985 953 -1552 -131 -1147 -93 -455 29 203 -248 129 -435 1198 -299 923 124 354 -23 197 686 -616 561 -206 1522 -1812 -171 -555 -387 313 -921 -661 -448 91 -948 -561 -329 348 -271 517 235 284 1056 -340 2151 251 1020 -507 325 923 543 1079 856 1211 545 760 41 404 -475 466 157 -177 -214 -506 50 -1211 1205 -188 128 716 249 695 -718 -1984 -2332 -942 -1712 -1600 -1864 -1135 -220 -615 946 -220 1265 1272 1633 1102 1456 791 -467 -609 -621 -423 904 1092 -1049 -782 -1630 -179 -481 637 92 -17 829 -462 470 970 325 181 643 -183 -560 -324 -751 -178 -364 1120 1231 1129 942 1427 -968 -1099 361 559 558 -124 581 275 -1047 -1365 -252 -240 -115 SS 20210322T083451.6Z 7751.357542 243 1 49.22 2 63.80 129.03 96.49 32.44 0.00 1 0.00 1 0 17 2.879e-02 5.280e-03 2.437e-02 3.335e-03 3.575068e-01 1.719103e-03 4.712962e-03 -6.000000e+00 1.699857e-02 225.59 -2.00 3.88 -2.00 318.80 0.00e+00 2.623638e-04 3.429877e-04 1.416152e-04 -6.000000e+00 6.896554e-04 269.14 -2.00 20.00 -2.00 318.49 0.00e+00 2.252 0.000 302.00 328.00 3 5.1700e+00 4.6207e-03 3.0231e-02 -6.0000e+00 4.2307e-02 7.1972e-02 5.2336e-03 2.0147e-02 -6.0000e+00 4.6064e-02 -1.3351e-02 3.7877e-03 1.0234e-02 -6.0000e+00 2.7123e-02 -9.4925e-04 2.0137e-03 3.0394e-03 -6.0000e+00 1.1292e-02 1.9785e-04 -4.3430e-04 1.0523e-04 3.7706e-05 -6.0000e+00 8.6402e-04 2.5367e-03 5.9159e-06 10 0 0 10 0 0 99.84 22.36 0.20 0.00254 -0.00073 28 5 1 5 0 1757.364 25.39 20.00 22.36 13.28 23.1 1028.03 -6374 8909 10475 -16932 409 2314 -12492 -10455 -5889 -2457 -1930 1854 -2913 930 -5909 993 -5723 -4368 5553 -3687 -2586 4860 2628 -1988 -790 2486 430 -1588 -3266 -929 -934 -2660 2961 -1283 -1321 1929 -3137 -349 -1915 946 -485 -1774 -1013 -489 37 -1752 1177 -755 188 540 656 1827 1383 1271 1036 760 187 129 446 1898 1359 1261 1491 643 439 -666 -596 -109 1115 -232 223 -37 127 100 280 -75 20 671 -1040 -459 -1441 -434 -1791 -901 -537 -779 138 -148 576 -504 468 577 646 550 231 704 777 238 -405 7 -348 -393 591 -271 -745 -719 -650 -270 73 -102 133 17 -312 149 -131 228 154 126 -573 -325 -335 301 137 581 35 166 660 488 320 568 151 219 72 606 125 224 442 -123 -625 -326 -320 -257 -209 -265 355 424 -847 16 88 -574 -526 -313 -134 -108 106 -197 71 -553 97 -639 -509 618 -465 -330 582 331 -277 -116 368 65 -235 -472 -132 -142 -453 520 -243 -244 343 -631 -79 -525 293 -168 -658 -386 -188 14 -686 446 -288 71 209 268 792 643 625 530 401 101 70 237 988 729 722 922 427 297 -438 -372 -67 715 -167 173 -30 104 79 207 -51 12 402 -659 -321 -1139 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