File name: Pandora30s1_Juelich_20201115_L2Fit_fout2c3d20191023p1-8.txt File generation date: 20251119T160059.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 30 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora30_OF_v4d20190910.txt Instrument calibration file used: Pandora30s1_CF_v3d20191023.txt Level 1 file used: Pandora30s1_Juelich_20201115_L1_smca1c3d20191023p1-8.txt Full location name: Juelich JULEY Short location name: Juelich Country of location: Germany Location latitude [deg]: 50.9080 Location longitude [deg]: 6.4130 Location altitude [m]: 94 Local noon date: 20201115 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 219 360 Nominal wavelengths inside fitting window [nm]: 305.0309 305.1726 305.3142 305.4558 305.5975 305.7391 305.8807 306.0223 306.1639 306.3054 306.4470 306.5885 306.7301 306.8716 307.0131 307.1546 307.2961 307.4376 307.5790 307.7205 307.8619 308.0034 308.1448 308.2862 308.4276 308.5690 308.7104 308.8518 308.9931 309.1345 309.2758 309.4171 309.5585 309.6998 309.8411 309.9823 310.1236 310.2649 310.4061 310.5474 310.6886 310.8298 310.9710 311.1122 311.2534 311.3945 311.5357 311.6769 311.8180 311.9591 312.1002 312.2413 312.3824 312.5235 312.6646 312.8057 312.9467 313.0877 313.2288 313.3698 313.5108 313.6518 313.7928 313.9337 314.0747 314.2156 314.3566 314.4975 314.6384 314.7793 314.9202 315.0611 315.2020 315.3428 315.4837 315.6245 315.7653 315.9062 316.0470 316.1877 316.3285 316.4693 316.6101 316.7508 316.8915 317.0323 317.1730 317.3137 317.4544 317.5950 317.7357 317.8764 318.0170 318.1576 318.2983 318.4389 318.5795 318.7201 318.8606 319.0012 319.1418 319.2823 319.4228 319.5634 319.7039 319.8444 319.9849 320.1253 320.2658 320.4062 320.5467 320.6871 320.8275 320.9679 321.1083 321.2487 321.3891 321.5295 321.6698 321.8101 321.9505 322.0908 322.2311 322.3714 322.5117 322.6519 322.7922 322.9324 323.0727 323.2129 323.3531 323.4933 323.6335 323.7737 323.9138 324.0540 324.1941 324.3343 324.4744 324.6145 324.7546 324.8947 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20201115T075116.5Z 7624.327274 82 1 48.98 2 83.08 131.28 83.57 128.56 0.00 1 0.00 1 0 17 7.589e-01 4.861e-02 2.199e-01 8.392e-03 8.061600e-01 4.704107e-03 9.838070e-03 -6.000000e+00 4.305324e-01 221.08 -2.00 3.80 -2.00 321.67 0.00e+00 -3.067602e-03 1.983243e-03 3.869028e-03 -6.000000e+00 2.103287e-02 272.19 -2.00 20.00 -2.00 321.23 0.00e+00 7.612 0.009 302.00 328.00 3 1.4729e+00 1.5226e-02 8.9804e-02 -6.0000e+00 1.0553e+00 1.1299e+00 1.8477e-02 5.3751e-02 -6.0000e+00 1.1512e+00 -1.5553e+00 1.4541e-02 2.5062e-02 -6.0000e+00 6.8415e-01 6.4317e-01 7.5380e-03 8.0359e-03 -6.0000e+00 3.0254e-01 3.0208e-05 -1.7107e-03 2.3704e-04 1.0389e-04 -6.0000e+00 2.1923e-02 -1.8063e-03 0.0000e+00 12 9 8 11 40 0 97.09 21.38 0.17 -0.00181 -0.01466 47 11 1 5 0 1041.850 26.62 20.01 21.38 21.27 35.5 997.38 900000 49075 -2578 900000 900000 49756 -94732 -35396 900000 -33565 -17118 -5557 900000 900000 -2207 60026 22831 188433 96253 4470 384221 900000 900000 -57553 900000 221922 -10775 900000 -86108 900000 223911 146088 68806 86480 16964 45792 55253 217901 900000 24901 900000 75556 146821 175509 12211 187871 39244 900000 -15698 91946 338518 -8115 21473 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1214 3363 -495 -2431 -5103 -202 -7086 -7730 -3383 1636 3544 -5220 -8955 -9127 -3193 -7676 1408 1853 -2055 -1113 -8031 -1871 1044 -294 -6216 1660 -34 7496 10048 2794 7616 4837 8880 2042 -2936 4137 -5802 2771 2138 6087 -904 4661 -4980 479 3103 1761 2486 -883 -8217 -7697 SS 20201115T083004.7Z 7624.354221 102 1 49.37 2 78.79 139.51 79.34 136.54 0.00 1 0.00 1 0 17 5.873e-01 5.442e-02 1.644e-01 6.539e-03 5.273680e-01 3.361458e-03 6.539447e-03 -6.000000e+00 3.284832e-01 221.08 -2.00 3.80 -2.00 320.37 0.00e+00 -6.460225e-03 1.145184e-03 1.032415e-03 -6.000000e+00 1.515471e-02 272.19 -2.00 20.00 -2.00 319.90 0.00e+00 4.969 0.003 302.00 328.00 3 4.2201e+00 9.9167e-03 5.7009e-02 -6.0000e+00 8.0628e-01 2.2649e-01 1.1884e-02 3.1331e-02 -6.0000e+00 8.7903e-01 -4.2027e-01 9.8980e-03 1.5103e-02 -6.0000e+00 5.2317e-01 2.0331e-01 5.0758e-03 6.9446e-03 -6.0000e+00 2.3012e-01 3.5312e-05 2.8481e-03 1.9515e-04 6.8636e-05 -6.0000e+00 1.6071e-02 -8.2664e-03 0.0000e+00 12 9 8 11 32 0 99.98 21.37 0.03 -0.00827 0.01314 18 4 1 5 0 2742.050 26.62 20.00 21.37 21.39 35.5 997.23 900000 -35344 -103272 900000 900000 218726 -158382 53544 51300 -30494 -53722 -23762 900000 70191 8072 32534 -2159 78319 7539 -42730 172330 900000 900000 -39459 209557 307896 -26747 159567 -70319 -14230 180430 70000 46645 7351 16453 45310 14576 110577 103817 37782 172342 47781 54266 65647 -3478 61470 21753 71285 -13593 18776 85646 24146 4523 35620 29058 18388 15049 22534 -26461 33399 39624 10868 5527 14194 -4441 -2463 -6089 -23420 -2397 2134 11416 5258 -3803 -6814 -7676 20125 -14718 14526 19300 -15081 11504 -1960 -9067 -2417 4424 -3248 -1624 2374 -1085 -9902 5345 2973 -1367 -1038 374 -2423 -2562 -437 -5252 -5224 32894 -1442 5115 -1578 -6401 -4405 -1235 -1961 4209 4144 -342 -1116 657 -3770 243 -1839 -3264 -81 60 2243 -479 2108 2180 3536 3786 2233 -2872 4098 -2524 2023 1308 2476 -314 1777 -1283 -757 1318 -178 519 166 -3722 -2232 900000 -1272 -7110 900000 900000 1393 -15803 871 929 -1282 -2891 -991 900000 1600 378 1407 -133 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320.01 0.00e+00 4.760 0.002 302.00 328.00 3 2.3684e+00 3.5095e-03 5.5803e-02 -6.0000e+00 4.5479e-01 4.8032e-02 4.4106e-03 3.1132e-02 -6.0000e+00 4.9598e-01 -6.9995e-02 4.3584e-03 1.7499e-02 -6.0000e+00 2.9509e-01 2.9981e-02 2.2337e-03 7.0155e-03 -6.0000e+00 1.2737e-01 2.5696e-04 -6.3196e-04 6.5015e-05 7.4818e-05 -6.0000e+00 8.7473e-03 -2.0692e-03 0.0000e+00 12 8 8 10 0 0 98.91 21.37 0.16 -0.00207 -0.00682 157 37 1 5 0 308.900 26.62 20.00 21.37 21.58 35.5 997.12 -37320 -105488 -132191 535 -45302 -95398 -153281 -80031 152429 -84040 -102888 -89747 124608 -25666 -41126 -21540 -37867 -13046 47458 -27584 1599 11901 20553 -32220 4900 10513 -30225 -2324 -43886 8945 8681 4664 3654 -3420 -2945 -7081 -3284 4132 10743 322 16470 1355 4290 6001 -2448 4921 2918 8663 -3465 2906 11407 -1795 1641 5045 4330 1892 1952 920 -5742 4001 6455 4515 2859 4174 461 1113 430 -3735 67 1251 2508 782 -1156 -708 -1856 1884 -4583 353 1239 -3404 1285 -1203 -3105 -1570 -270 -803 1297 583 1313 -749 1468 772 -895 218 -829 -372 130 864 -239 -940 -575 -614 581 -970 -2019 -1907 -848 -935 276 955 474 545 -248 -273 127 -331 -165 321 159 17 661 672 1060 911 775 -273 -219 705 -446 56 -29 141 -199 184 -302 -310 642 179 201 69 -632 -888 -271 -1816 -3255 4 -424 -1398 -4214 -1197 345 -1612 -2471 -2061 444 -492 -1162 -602 -1407 -416 896 -1167 52 349 568 -1630 185 397 -1749 -99 -2771 351 399 266 243 -246 -216 -496 -258 336 1004 40 1952 201 649 918 -414 791 488 1403 -657 548 2181 -411 396 1272 1158 538 569 269 -1746 1093 1792 1417 1037 1664 197 456 172 -1604 29 619 1341 441 -652 -374 -904 839 -2042 153 602 -1934 807 -829 -2356 -1240 -226 -719 1195 553 1224 -680 1209 596 -676 170 -740 -362 145 1026 -304 -1173 -688 -660 584 -1037 -2356 -2340 -1089 -1225 393 1435 775 912 -409 -425 194 -492 -251 491 260 29 1080 1056 1683 1394 1141 -389 -307 1062 -732 101 -54 271 -404 379 -665 -706 1476 418 461 150 -1305 -1828 SS 20201115T084057.5Z 7624.361777 108 1 49.00 2 77.71 141.90 78.26 138.85 0.00 1 0.00 1 0 17 2.343e-01 8.087e-03 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