File name: Pandora21s1_Bremen_20220402_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T102259.6Z 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_20220402_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: 20220402 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 20220402T064335.2Z 8127.280268 103 1 49.71 2 74.83 102.25 81.17 90.87 0.00 1 0.00 1 0 25 2.007e-01 5.113e-03 1.230e-01 1.862e-03 6.371334e-01 1.007425e-03 7.966254e-03 -6.000000e+00 1.192404e-01 226.51 -2.00 3.88 -2.00 320.78 0.00e+00 1.266963e-03 3.539011e-04 5.901047e-04 -6.000000e+00 4.808118e-03 270.52 -2.00 20.00 -2.00 320.48 0.00e+00 3.750 0.001 302.00 328.00 3 2.3659e+00 2.9382e-03 5.2660e-02 -6.0000e+00 2.9745e-01 5.3746e-02 3.8581e-03 3.7346e-02 -6.0000e+00 3.2329e-01 -2.6286e-02 4.3544e-03 2.0553e-02 -6.0000e+00 1.9024e-01 -1.8232e-03 2.2309e-03 6.7322e-03 -6.0000e+00 7.9339e-02 5.5703e-04 -7.6414e-04 5.6713e-05 8.5590e-05 -6.0000e+00 6.0201e-03 -1.8077e-02 7.5065e-05 10 0 0 10 0 0 94.65 22.21 0.19 -0.01808 -0.02382 168 33 1 5 0 295.315 25.17 20.01 22.21 8.43 27.7 1010.06 -94555 -84843 -70268 -1168 -54390 95127 -80787 -32390 -83728 -4179 -55337 -2997 -6969 -31020 -3362 -26773 -6410 -25817 8696 -20537 -12525 -8943 2573 -1664 -5037 883 -14783 -3154 -18157 -145 1749 3247 -3506 -1255 2687 -2622 -594 -9367 -1452 -5513 -1298 -2373 -796 -245 673 -2511 -2013 988 -910 2143 385 1856 786 839 2091 -471 1469 112 999 -270 2578 1164 1443 386 727 1598 1284 1548 1281 826 -197 127 -170 311 -330 403 1118 56 767 -656 -404 -1388 -1620 -1384 -1202 -511 -456 -220 -205 593 655 1463 1183 1566 809 674 935 185 -355 -330 -121 -409 688 164 -734 -873 -653 -636 -296 -210 -276 -114 -229 17 275 800 561 357 44 -604 -545 -328 -307 -208 37 228 800 1180 588 375 143 259 141 236 -183 -143 -11 -5 -437 -138 -104 -80 229 -670 -646 -511 -5 -331 173 -657 -193 -885 -24 -536 -21 -60 -406 -42 -488 -111 -581 157 -506 -299 -211 57 -41 -140 25 -488 -93 -612 -4 59 127 -166 -63 131 -134 -32 -634 -110 -515 -133 -266 -93 -29 82 -320 -261 128 -126 307 61 324 152 177 464 -112 356 28 241 -65 615 303 418 126 252 551 439 537 480 350 -93 63 -85 149 -148 164 421 21 308 -306 -217 -856 -1101 -1002 -920 -412 -386 -192 -180 503 528 1100 853 1129 631 592 930 209 -435 -416 -147 -462 711 166 -776 -975 -763 -783 -388 -301 -431 -189 -384 27 434 1206 835 544 70 -1004 -915 -539 -488 -321 56 328 1113 1644 881 619 258 493 281 491 -401 -327 -26 -11 -1048 -325 -235 -173 475 SS 20220402T065103.1Z 8127.285452 107 1 49.54 2 73.74 103.81 80.06 92.31 0.00 1 0.00 1 0 25 2.176e-01 5.840e-03 9.893e-02 1.622e-03 5.968167e-01 8.699371e-04 7.529740e-03 -6.000000e+00 1.292662e-01 226.51 -2.00 3.88 -2.00 320.54 0.00e+00 1.138400e-03 2.879715e-04 4.939325e-04 -6.000000e+00 5.212453e-03 270.53 -2.00 20.00 -2.00 320.24 0.00e+00 3.513 0.001 302.00 328.00 3 2.4715e+00 2.5004e-03 4.9231e-02 -6.0000e+00 3.2246e-01 4.4263e-02 3.1644e-03 3.4683e-02 -6.0000e+00 3.5048e-01 -2.4674e-02 3.4090e-03 1.8759e-02 -6.0000e+00 2.0624e-01 1.5152e-04 1.7707e-03 6.0344e-03 -6.0000e+00 8.6009e-02 6.5816e-04 -7.1668e-04 4.9588e-05 7.5946e-05 -6.0000e+00 6.5265e-03 -1.8105e-02 6.5816e-05 10 0 0 10 0 0 92.25 22.21 0.20 -0.01810 -0.02349 161 32 1 5 0 307.649 25.17 20.00 22.21 8.71 28.0 1011.68 -100902 13115 -74796 25171 -103757 96318 -91977 83204 -45810 -44514 -30045 -45991 11889 -36953 29853 -24673 10501 -13192 2540 -20093 -5280 4673 -12783 11122 -15938 14628 -11551 6197 -10984 4520 -5595 -5793 4758 -8269 4859 -7221 8418 -6115 1304 -1666 -749 -1581 -3481 1236 -2149 1767 -1078 2978 -1490 2581 1584 1620 1131 82 1882 -452 2045 -1310 2251 -1049 3097 746 1305 853 -362 1647 554 2181 337 1383 -205 115 -609 -28 281 -409 1421 -354 1345 -722 185 -951 -1272 -1493 -1578 -519 -943 108 -282 713 627 1209 1178 1418 1102 199 902 86 0 -617 28 -604 630 107 -883 -940 -937 -246 -476 61 -268 -157 -221 277 316 451 742 341 228 -676 -420 -349 -148 -362 79 290 654 1357 346 460 104 286 98 262 -150 -238 54 -83 -324 -382 39 -200 346 -1089 60 -804 111 -1375 207 -1152 245 -483 -505 -321 -626 116 -678 371 -579 203 -345 62 -636 -152 125 -416 315 -623 461 -471 214 -438 164 -251 -302 257 -542 283 -468 507 -488 117 -182 -92 -213 -502 176 -321 259 -166 451 -245 432 291 329 253 20 481 -124 564 -376 615 -291 842 223 431 313 -142 636 212 832 141 640 -106 63 -336 -15 139 -185 587 -146 584 -364 106 -624 -917 -1149 -1285 -443 -849 99 -262 641 537 968 900 1078 898 183 927 100 0 -794 35 -699 670 111 -965 -1084 -1131 -310 -642 89 -422 -261 -371 454 498 680 1100 519 361 -1120 -703 -574 -236 -562 118 420 915 1893 519 753 185 534 190 531 -320 -528 122 -192 -752 -875 87 -422 703 SS 20220402T065635.8Z 8127.289303 110 1 17.77 2 72.93 104.98 79.23 93.38 0.00 1 0.00 1 0 25 1.996e-01 5.477e-03 1.095e-01 2.270e-03 5.709036e-01 1.199393e-03 7.273334e-03 -6.000000e+00 1.185993e-01 226.51 -2.00 3.88 -2.00 320.03 0.00e+00 3.168704e-04 3.537717e-04 3.924491e-04 -6.000000e+00 4.781734e-03 270.53 -2.00 20.00 -2.00 319.75 0.00e+00 3.356 0.001 302.00 328.00 3 2.7417e+00 3.3602e-03 4.6905e-02 -6.0000e+00 2.9585e-01 3.8957e-02 4.0680e-03 3.2765e-02 -6.0000e+00 3.2154e-01 -1.4426e-02 4.0647e-03 1.7282e-02 -6.0000e+00 1.8921e-01 -4.9496e-03 2.1565e-03 5.3935e-03 -6.0000e+00 7.8924e-02 6.0108e-04 -3.7158e-04 6.8184e-05 6.5962e-05 -6.0000e+00 5.9861e-03 -1.9234e-02 8.1555e-05 12 1 1 12 1 1 73.07 22.21 0.16 -0.01923 -0.02203 41 23 1 5 0 418.810 25.17 20.00 22.21 8.90 27.9 1012.68 -79558 193745 -50689 11242 -16677 32580 -27612 -26218 -17951 -29281 7527 -35664 15219 -31981 14884 -9294 3053 -6171 -2915 1444 -4312 3211 -5277 -915 -7453 4674 -8906 2524 -7787 -4460 6750 -6 7926 -7175 5740 -8694 1172 -6329 -2844 -3272 -798 -872 -1373 888 -2420 258 314 -149 -441 124 1198 -800 2869 310 711 -526 1552 -368 -33 445 860 1723 1271 1147 -103 1396 659 1806 493 1242 116 -48 -6 -373 399 -783 592 105 945 -645 -199 -969 -1408 -1006 -1398 -544 -630 4 -218 74 577 1115 999 1227 1334 471 833 137 -74 -419 -253 -264 18 191 -1056 -532 -1029 -251 -459 50 -242 -229 -154 2 539 588 796 326 162 -614 -480 -395 -136 -56 -3 343 513 1375 488 416 111 177 137 39 -9 -180 28 -149 -382 -367 -123 -13 308 -1094 429 -662 83 -154 191 -299 -302 -218 -437 88 -644 209 -796 300 -269 89 -216 -107 54 -176 124 -221 -40 -379 224 -501 124 -418 -241 368 0 571 -620 455 -758 104 -681 -360 -497 -135 -154 -256 166 -475 50 62 -30 -92 27 283 -214 813 98 237 -179 533 -130 -12 157 307 629 519 520 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