File name: Pandora21s1_Bremen_20210522_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T073200.2Z 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_20210522_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: 20210522 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 20210522T133433.1Z 7812.565661 532 1 43.81 2 41.38 231.02 93.14 84.64 0.00 1 0.00 1 0 17 8.839e-03 4.933e-03 4.868e-03 1.861e-03 2.143547e-01 9.797277e-04 2.865774e-03 -6.000000e+00 5.340633e-03 231.66 -2.00 3.88 -2.00 316.98 0.00e+00 6.462138e-05 1.162560e-04 4.400312e-05 -6.000000e+00 2.117565e-04 277.01 -2.00 20.00 -2.00 316.65 0.00e+00 1.331 0.000 302.00 328.00 3 5.1069e+00 2.5888e-03 1.8340e-02 -6.0000e+00 1.3484e-02 2.3048e-02 2.8774e-03 1.2372e-02 -6.0000e+00 1.4613e-02 6.0386e-03 1.7020e-03 6.0824e-03 -6.0000e+00 8.5646e-03 -5.5581e-03 8.0420e-04 1.7079e-03 -6.0000e+00 3.5240e-03 6.5654e-04 -1.8913e-04 5.8570e-05 2.2117e-05 -6.0000e+00 2.6569e-04 -1.9771e-03 1.1051e-05 12 1 1 12 1 1 100.00 22.38 0.15 -0.00198 -0.00340 107 24 1 5 0 404.026 25.39 20.00 22.38 18.22 24.5 1008.68 -2428 -1719 -2057 -1771 -386 -1514 1665 -2606 2529 -2042 1988 882 -405 635 -948 975 -1029 1126 -179 912 -458 1168 719 175 1138 -157 240 -1310 2079 138 2705 276 894 -476 -909 349 -1506 784 -1061 -1172 -1404 -884 -999 -696 -448 -692 -338 -1207 259 -178 978 5 835 538 436 1156 133 679 405 1588 1010 1517 611 409 154 -193 282 76 772 -68 631 -353 11 -206 212 577 -274 -70 -366 34 -849 -960 -1432 -836 -1005 -608 -270 -278 337 -20 324 50 650 665 512 550 971 495 -236 -180 -560 -377 -224 99 -760 -510 -455 -435 223 102 22 -75 123 -229 -76 216 292 180 110 90 -513 49 -226 257 134 306 693 655 695 140 442 -67 278 261 22 0 109 176 -315 27 -551 -206 -426 -349 -264 -322 -261 -52 -196 218 -392 397 -349 328 151 -76 132 -223 244 -273 302 -50 260 -135 339 213 54 367 -53 80 -422 612 40 794 88 300 -165 -305 114 -534 312 -503 -635 -830 -544 -631 -443 -284 -437 -209 -733 152 -105 588 3 558 376 313 841 99 503 297 1150 753 1188 514 360 136 -162 220 58 603 -58 584 -344 11 -198 191 479 -210 -51 -270 27 -751 -923 -1468 -892 -1132 -724 -337 -356 433 -26 385 55 661 648 511 588 1124 622 -314 -239 -720 -455 -258 115 -940 -664 -615 -609 323 155 35 -120 191 -340 -105 282 374 236 152 132 -775 74 -335 369 185 405 879 818 895 190 627 -97 411 394 35 -1 184 303 -550 47 -933 -338 -688 SS 20210522T133940.9Z 7812.569223 535 1 17.13 2 41.98 232.58 92.41 85.65 0.00 1 0.00 1 0 17 9.716e-03 5.202e-03 4.832e-03 2.094e-03 2.149450e-01 1.108148e-03 2.883539e-03 -6.000000e+00 5.871138e-03 231.66 -2.00 3.88 -2.00 316.56 0.00e+00 2.550139e-04 1.197938e-04 3.965928e-05 -6.000000e+00 2.327442e-04 277.01 -2.00 20.00 -2.00 316.24 0.00e+00 1.344 0.000 302.00 328.00 3 4.8586e+00 2.9152e-03 1.8450e-02 -6.0000e+00 1.4824e-02 2.6970e-02 3.2355e-03 1.2406e-02 -6.0000e+00 1.6064e-02 3.5673e-03 1.8874e-03 6.0926e-03 -6.0000e+00 9.4150e-03 -3.0668e-03 8.7476e-04 1.7042e-03 -6.0000e+00 3.8746e-03 8.2876e-04 -9.6321e-05 6.5368e-05 2.2522e-05 -6.0000e+00 2.9201e-04 -2.3231e-03 4.5337e-05 12 1 1 12 1 1 99.99 22.38 0.17 -0.00232 -0.00305 46 27 1 5 0 360.823 25.39 19.99 22.38 18.45 24.6 1011.06 -3590 1109 -4282 674 -3732 2353 695 1753 1046 -1569 1192 -2274 2702 -2073 689 -847 475 -212 198 509 -307 241 -249 151 -64 1354 -919 434 1302 2499 1195 578 735 -642 389 -470 171 -969 -20 -747 -1344 -742 -1009 -455 -787 -496 -1059 -429 -504 407 38 897 1039 460 973 573 571 375 665 819 1142 1557 834 589 -319 89 -314 948 230 625 -134 210 -90 -617 -71 -275 124 229 311 -410 -402 -1318 -1391 -914 -900 -820 -486 10 9 -228 370 332 622 610 962 250 650 436 17 -168 -223 -602 -12 -98 -743 -623 -373 -61 44 318 87 -162 -190 -70 184 50 371 55 306 -407 -357 -237 -220 187 664 361 530 993 430 572 -95 209 262 282 155 -138 497 -282 -175 -291 -137 -564 -382 -608 193 -795 113 -600 342 107 294 192 -308 229 -461 567 -507 183 -246 142 -66 63 165 -102 80 -84 53 -23 504 -347 155 436 807 402 207 278 -250 145 -174 67 -435 -10 -438 -856 -490 -683 -310 -537 -336 -710 -279 -322 258 25 612 740 342 738 444 447 294 516 633 899 1282 731 539 -294 78 -259 752 190 558 -129 209 -91 -611 -67 -241 100 175 242 -345 -368 -1309 -1458 -994 -1025 -982 -606 13 12 -287 441 371 648 612 982 273 760 548 22 -222 -284 -730 -14 -115 -920 -807 -499 -84 63 468 132 -250 -288 -101 251 65 472 72 416 -582 -525 -350 -319 264 902 474 671 1236 552 767 -133 298 378 415 237 -218 805 -467 -292 -482 -222 -897 -595 SS 20210522T145020.7Z 7812.618295 578 1 49.59 2 51.34 251.45 82.43 99.55 0.00 1 0.00 1 0 25 4.547e-02 1.156e-02 3.942e-02 9.486e-03 2.840984e-01 4.993711e-03 3.799957e-03 -6.000000e+00 2.746277e-02 231.67 -2.00 3.88 -2.00 317.94 0.00e+00 1.354379e-04 7.607703e-04 7.937086e-05 -6.000000e+00 1.089389e-03 277.02 -2.00 20.00 -2.00 317.61 0.00e+00 1.597 0.000 302.00 328.00 3 7.0896e+00 1.3354e-02 2.3243e-02 -6.0000e+00 6.9337e-02 1.0641e-01 1.4914e-02 1.6501e-02 -6.0000e+00 7.5156e-02 4.1070e-04 9.4647e-03 8.1608e-03 -6.0000e+00 4.4047e-02 -8.4096e-03 4.7554e-03 2.3140e-03 -6.0000e+00 1.8115e-02 5.8993e-05 -8.1208e-04 3.0043e-04 2.9312e-05 -6.0000e+00 1.3670e-03 -5.9969e-04 -7.4276e-05 12 8 8 10 0 0 99.15 22.39 0.26 -0.00060 -0.00670 20 4 1 5 0 2476.945 25.39 20.00 22.39 19.58 24.2 1014.54 -29019 1091 16533 9497 14633 -5506 3250 -6471 1001 7360 2695 -13069 2315 1729 10013 -1431 6870 9170 -8453 -1021 16477 3266 -11759 1271 -151 2722 3151 528 5351 3862 846 409 3376 7230 3398 -6311 -3389 -2167 956 -64 -1914 -2800 -1537 -2027 -885 612 -120 -1657 -1720 -149 -1002 -294 318 -2634 -654 1541 3226 -618 1644 1370 1697 947 515 1504 474 604 173 -669 1061 43 -2086 2164 1881 -26 -767 -686 -2117 -1625 -853 -1502 -521 -2623 -852 -2211 297 501 524 1004 75 966 2136 754 -132 -533 -846 753 2325 1042 712 506 -122 -1206 -2198 -1489 -1740 -1323 -487 -108 196 624 307 1137 -129 275 -273 -1647 151 -1261 -956 -394 675 -149 -8 -698 537 938 619 1585 717 -93 -899 -244 444 902 627 110 -66 831 81 -493 -25 -1318 -79 -3025 94 1262 737 1004 -437 250 -601 95 694 269 -1566 265 227 1375 -240 1124 1531 -1733 -202 2815 634 -2690 270 -34 622 714 117 1079 779 184 97 831 1761 831 -1672 -935 -682 345 -27 -901 -1399 -781 -1047 -453 307 -60 -822 -844 -73 -514 -160 182 -1629 -410 969 2029 -403 1034 859 1086 648 381 1165 374 452 122 -462 755 34 -1841 1924 1685 -23 -641 -524 -1491 -1081 -579 -1128 -433 -2443 -836 -2315 321 576 634 1248 95 1172 2412 794 -129 -505 -830 791 2654 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