File name: Pandora21s1_Bremen_20220627_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T112358.1Z 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_20220627_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: 20220627 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 20220627T090038.4Z 8213.375444 293 1 12.50 2 40.70 122.48 31.06 150.70 0.00 1 0.00 1 0 17 7.474e-03 5.148e-03 3.539e-03 2.033e-03 1.879067e-01 1.092672e-03 2.520591e-03 -6.000000e+00 4.561245e-03 233.78 -2.00 3.88 -2.00 315.63 0.00e+00 1.115631e-04 9.557980e-05 2.565685e-05 -6.000000e+00 1.790646e-04 281.08 -2.00 20.00 -2.00 315.33 0.00e+00 1.318 0.000 302.00 328.00 3 4.8437e+00 2.8621e-03 1.7242e-02 -6.0000e+00 1.1579e-02 1.7746e-02 3.1605e-03 1.0939e-02 -6.0000e+00 1.2516e-02 5.7171e-03 1.8057e-03 5.3251e-03 -6.0000e+00 7.3237e-03 -2.4672e-03 7.9751e-04 1.4706e-03 -6.0000e+00 3.0098e-03 9.1457e-04 -8.6054e-06 6.2474e-05 2.0580e-05 -6.0000e+00 2.2462e-04 -1.8787e-02 8.0319e-05 12 1 1 12 1 1 99.95 22.45 0.22 -0.01879 -0.01885 13 11 1 5 0 879.559 25.47 20.00 22.45 25.71 30.0 997.35 -1540 -511 -1826 -3150 -403 -984 857 -456 811 922 -1106 1728 -415 1111 -522 -640 -792 -690 1783 -139 475 1167 1174 56 1364 0 -522 -132 914 1271 1652 1481 588 -435 -345 -270 -733 -539 -579 -621 -774 -1184 -698 -1098 -690 -915 -832 -826 -741 786 588 1067 584 560 275 599 626 579 688 946 983 1403 1337 688 37 42 181 264 262 84 -150 -103 -54 -301 199 162 -213 133 111 -906 -686 -973 -1135 -889 -807 -626 -458 -148 2 -312 -69 -59 233 722 658 681 602 472 -117 -192 -195 -267 81 22 -463 -703 -350 -367 -20 88 12 13 130 -78 12 -69 151 209 228 -166 -254 -102 10 9 440 216 513 1069 836 316 640 -161 308 643 -56 -122 87 -35 -327 -318 -314 -405 -500 -377 -133 -487 -812 -94 -218 192 -112 215 255 -312 480 -125 362 -189 -248 -318 -283 734 -60 206 503 511 25 635 0 -252 -61 399 536 704 661 277 -210 -162 -124 -353 -289 -352 -421 -564 -898 -538 -856 -536 -709 -636 -616 -542 565 431 810 462 457 230 507 535 496 585 800 843 1248 1246 668 36 39 161 226 230 79 -150 -107 -57 -310 197 152 -186 110 92 -801 -651 -985 -1206 -976 -920 -745 -566 -187 2 -392 -83 -68 250 743 683 740 696 580 -149 -247 -245 -321 94 26 -562 -891 -457 -491 -28 125 18 19 188 -109 16 -88 187 264 298 -227 -357 -143 14 12 583 277 637 1304 1040 409 851 -218 423 894 -80 -181 132 -54 -509 -492 -480 -608 -739 SS 20220627T090553.4Z 8213.379090 296 1 41.60 2 40.04 124.04 30.68 152.86 0.00 1 0.00 1 0 17 8.427e-03 5.050e-03 4.970e-03 2.419e-03 1.945383e-01 1.292091e-03 2.591574e-03 -6.000000e+00 5.143045e-03 233.78 -2.00 3.88 -2.00 316.23 0.00e+00 3.096115e-04 1.283783e-04 3.238140e-05 -6.000000e+00 2.018963e-04 281.08 -2.00 20.00 -2.00 315.92 0.00e+00 1.305 0.000 302.00 328.00 3 5.9370e+00 3.4030e-03 1.7414e-02 -6.0000e+00 1.3055e-02 4.5758e-02 3.7641e-03 1.1307e-02 -6.0000e+00 1.4113e-02 -3.1595e-03 2.1712e-03 5.5080e-03 -6.0000e+00 8.2576e-03 2.1090e-04 9.8425e-04 1.5255e-03 -6.0000e+00 3.3938e-03 3.0322e-04 1.3952e-04 7.5197e-05 2.0339e-05 -6.0000e+00 2.5324e-04 -1.8920e-02 9.5624e-05 12 1 1 12 1 1 99.89 22.45 0.30 -0.01892 -0.01787 11 3 1 5 0 3450.841 25.47 19.99 22.45 26.14 30.0 999.56 -2589 -1506 -2869 -962 -4772 -592 82 414 783 -505 355 178 -894 987 69 431 -381 473 1149 -396 1372 1294 1650 633 425 1531 -111 -330 -371 1661 -95 1475 1544 -282 -665 -977 -557 -763 -817 -281 -509 -1154 -1127 -629 -576 -505 -614 -1380 -486 449 52 1118 509 504 416 866 619 445 276 732 890 370 1175 598 709 278 -318 -312 452 431 464 673 67 93 -247 140 -156 -1014 -519 -423 -705 -1381 -1416 -1202 -979 -275 -35 -36 43 159 52 306 -181 376 265 639 533 648 15 -57 133 -507 -261 375 -540 -1006 -396 -189 16 388 48 228 -164 168 -193 4 -268 -32 -204 67 -383 289 233 -20 365 88 773 862 402 236 191 401 58 184 -161 31 239 201 -221 -207 -331 -736 -122 -510 -317 -622 -195 -916 -103 15 81 166 -114 79 40 -219 264 21 138 -128 162 402 -144 501 473 607 243 170 626 -46 -131 -139 589 -35 561 619 -117 -269 -387 -231 -358 -444 -172 -340 -810 -809 -455 -415 -362 -434 -955 -326 297 35 787 376 387 327 691 501 361 223 585 722 316 1054 562 669 251 -270 -255 375 387 449 679 69 93 -239 126 -129 -795 -406 -354 -645 -1369 -1485 -1311 -1115 -328 -43 -46 56 202 63 347 -192 378 270 687 617 804 20 -75 170 -615 -303 435 -661 -1297 -527 -259 22 566 73 349 -247 242 -262 5 -338 -40 -272 95 -557 421 335 -28 493 115 967 1057 505 310 260 557 81 265 -240 48 380 325 -362 -336 -529 -1153 -187 SS 20220627T091611.6Z 8213.386245 299 1 50.14 2 38.79 127.19 30.03 157.20 0.00 1 0.00 1 0 17 6.526e-03 4.966e-03 1.797e-03 9.462e-04 1.822829e-01 5.052249e-04 2.440348e-03 -6.000000e+00 3.982311e-03 233.78 -2.00 3.88 -2.00 316.00 0.00e+00 3.663072e-05 4.785183e-05 2.785515e-05 -6.000000e+00 1.563400e-04 281.08 -2.00 20.00 -2.00 315.70 0.00e+00 1.282 0.000 302.00 328.00 3 4.5546e+00 1.3276e-03 1.6754e-02 -6.0000e+00 1.0109e-02 1.5692e-02 1.4682e-03 1.0619e-02 -6.0000e+00 1.0928e-02 6.6831e-03 8.4299e-04 5.1684e-03 -6.0000e+00 6.3942e-03 -3.5754e-03 3.7702e-04 1.4271e-03 -6.0000e+00 2.6277e-03 1.2808e-03 -6.0785e-05 2.9144e-05 1.9497e-05 -6.0000e+00 1.9612e-04 -1.8747e-02 7.1468e-05 10 0 0 10 0 0 99.93 22.46 0.24 -0.01875 -0.01920 62 12 1 5 0 808.623 25.47 20.00 22.46 27.09 29.8 1003.38 -741 -2179 -1028 -2515 -553 -420 -370 451 -129 -192 -166 1106 -389 -118 -123 -379 -346 -53 355 286 649 911 1128 422 604 317 -377 -167 1082 1327 752 1387 865 123 -721 67 -587 -261 -68 -960 -1011 -1019 -779 -985 -701 -877 -748 -1001 -375 373 397 847 626 645 588 809 839 642 520 938 1156 1005 1085 499 25 -23 -79 121 792 169 -124 51 -244 -127 3 58 24 348 215 -357 -512 -1034 -1344 -1172 -905 -864 -388 -218 -83 -193 134 140 313 799 710 661 682 542 -273 -186 -292 -622 47 283 -445 -565 -525 -301 -100 82 79 -56 -94 -42 -80 289 263 412 245 -132 -443 -76 -67 -35 380 227 870 909 719 566 354 96 271 230 18 -120 82 1 -288 -186 -316 -596 -291 -164 -491 -250 -587 -115 -82 -74 98 -31 -48 -42 278 -106 -36 -42 -128 -122 -19 131 108 249 348 434 170 254 138 -164 -69 442 518 299 578 382 56 -318 28 -266 -125 -39 -634 -685 -727 -569 -728 -515 -640 -533 -691 -267 260 284 636 464 498 468 655 688 527 423 755 948 872 1007 491 25 -21 -68 98 656 155 -126 51 -247 -125 3 53 20 282 175 -295 -471 -1050 -1377 -1263 -1033 -1055 -471 -275 -105 -240 166 158 342 817 735 735 780 681 -348 -238 -381 -757 54 324 -546 -742 -681 -406 -140 120 115 -82 -144 -60 -106 374 329 528 334 -182 -640 -110 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