File name: Pandora30s1_Juelich_20201127_L2Fit_fout2c3d20191023p1-8.txt File generation date: 20251119T160220.9Z 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_20201127_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: 20201127 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 20201127T081332.3Z 7636.342735 219 1 48.63 2 83.18 136.52 119.91 343.08 0.00 1 0.00 1 0 25 6.921e-01 7.554e-02 1.876e-01 1.225e-02 8.255523e-01 6.870294e-03 9.967293e-03 -6.000000e+00 3.942640e-01 220.84 -2.00 3.80 -2.00 321.42 0.00e+00 -1.268636e-02 2.205664e-03 2.833692e-03 -6.000000e+00 1.956664e-02 270.86 -2.00 20.00 -2.00 320.93 0.00e+00 7.706 0.010 302.00 328.00 3 1.8480e+00 2.0557e-02 9.0441e-02 -6.0000e+00 9.6686e-01 1.4996e+00 2.4256e-02 5.6175e-02 -6.0000e+00 1.0567e+00 -1.7398e+00 1.6457e-02 2.2730e-02 -6.0000e+00 6.2762e-01 6.4123e-01 8.8711e-03 1.2142e-02 -6.0000e+00 2.7839e-01 1.6505e-05 -1.9125e-04 3.4455e-04 1.3200e-04 -6.0000e+00 2.0521e-02 2.1448e-04 0.0000e+00 12 9 8 11 32 0 64.33 21.26 0.46 0.00021 -0.00122 28 7 1 5 0 1736.500 26.51 20.00 21.26 10.12 35.0 1008.56 900000 49283 5535 900000 900000 222162 -79039 91699 900000 13045 -19730 14678 900000 145272 44153 100249 26120 144184 900000 17568 114531 900000 900000 -14804 232685 900000 -8568 900000 -68042 900000 900000 118338 148321 36750 47502 59677 57355 900000 900000 71364 900000 118084 128032 212725 1199 145607 56528 900000 -7896 17601 900000 -31749 5223 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16480 7649 9775 -8844 10314 8631 2093 8349 2633 133 -1938 1626 -6546 -15150 -7312 3044 9882 -3345 -13382 -10209 -3754 -7540 1363 6332 -4387 -520 -14199 -2683 5222 -4767 -6468 222 -765 6337 15139 2763 8181 9562 9352 4472 -10095 6769 -13076 2187 6059 11316 1277 3909 -6605 -1865 6430 2083 4155 2533 -13540 -8233 SS 20201127T082034.1Z 7636.347617 223 1 48.26 2 82.43 137.98 120.18 344.99 0.00 1 0.00 1 0 17 5.771e-01 4.450e-02 2.009e-01 7.701e-03 7.832964e-01 4.188279e-03 9.617077e-03 -6.000000e+00 3.249803e-01 220.84 -2.00 3.80 -2.00 321.58 0.00e+00 9.119131e-03 1.744440e-03 1.076150e-03 -6.000000e+00 1.466910e-02 270.86 -2.00 20.00 -2.00 321.16 0.00e+00 7.053 0.007 302.00 328.00 3 1.8216e+00 1.3273e-02 8.1665e-02 -6.0000e+00 8.0125e-01 1.0240e+00 1.6175e-02 4.4254e-02 -6.0000e+00 8.7590e-01 -1.3606e+00 1.3352e-02 2.3464e-02 -6.0000e+00 5.1845e-01 5.5847e-01 6.8493e-03 1.0617e-02 -6.0000e+00 2.2349e-01 3.5366e-05 -2.2396e-03 2.1009e-04 1.4579e-04 -6.0000e+00 1.5572e-02 6.7736e-04 0.0000e+00 12 8 8 10 0 0 44.33 21.26 0.47 0.00068 -0.01615 48 11 1 5 0 1005.090 26.51 19.99 21.26 10.46 35.2 1008.67 204428 -22538 -42627 900000 182554 27350 -133547 -26975 900000 -60248 -88011 -53308 900000 21894 -20813 33088 6385 84667 900000 -4511 112162 900000 111676 -40325 89884 160691 -49203 133051 46227 900000 205374 97491 56341 23973 34835 10479 8676 135643 151103 49203 900000 62500 87611 110409 771 72811 48005 122389 17550 42534 187940 -10726 12744 82497 56106 41625 24716 42744 -34424 61338 89500 47407 20685 24445 5879 17153 15246 -20257 9404 11311 29799 15794 976 -312 -13610 42756 -24019 21022 29050 -19416 22314 1094 -6029 -1291 5766 -1764 14143 4884 7232 -9640 10322 6243 -2146 4588 -3812 -4194 -3439 -131 -3304 -6610 -5707 1721 7281 -4708 -9770 -6158 -3843 -5171 -753 2887 -1831 -208 -3924 -1254 1824 -1724 -1657 -376 532 2451 6061 2178 3809 4852 4610 3657 -3222 2232 -2520 1195 1894 3009 613 1009 -1437 -286 1272 47 -75 743 -3605 -2828 1533 -1200 -2813 900000 1369 604 -13019 -948 900000 -2901 -5349 -2377 900000 717 -1298 1410 388 2473 900000 -324 2523 900000 2187 -3406 2172 1874 -4253 1829 1444 900000 1626 2721 2699 1571 1988 703 607 2995 3336 3444 900000 4322 4818 4830 94 4580 3900 4844 1946 4093 4891 -2007 2027 7321 6685 5487 3843 5348 -8777 6082 6823 6063 3747 4824 1471 3744 3346 -6564 2513 3384 8009 4981 343 -102 -4518 7553 -7413 4339 6432 -8015 7521 495 -3187 -686 3027 -1054 7525 2901 4135 -6209 5066 3010 -1111 2394 -2518 -3299 -3005 -128 -3586 -7308 -5735 1487 5482 -4112 -9214 -5913 -3844 -5717 -902 3656 -2716 -321 -6288 -1891 2545 -2440 -2418 -574 850 3890 8956 3182 5299 6790 6267 4839 -4564 3328 -4390 2182 3765 6293 1395 2352 -3658 -741 3290 124 -192 1770 -8639 -6294 SS 20201127T083128.2Z 7636.355188 226 1 48.41 2 81.30 140.29 120.53 347.97 0.00 1 0.00 1 0 17 5.667e-01 2.835e-02 1.355e-01 4.202e-03 7.196486e-01 2.249989e-03 9.180890e-03 -6.000000e+00 3.185360e-01 220.84 -2.00 3.80 -2.00 321.36 0.00e+00 1.576694e-02 9.939465e-04 2.254625e-03 -6.000000e+00 1.424021e-02 270.86 -2.00 20.00 -2.00 320.95 0.00e+00 6.252 0.005 302.00 328.00 3 1.7567e+00 7.1829e-03 7.3338e-02 -6.0000e+00 7.8540e-01 4.8531e-01 9.5817e-03 4.1764e-02 -6.0000e+00 8.5849e-01 -6.9785e-01 9.6945e-03 2.8022e-02 -6.0000e+00 5.0782e-01 3.0174e-01 4.7659e-03 1.7831e-02 -6.0000e+00 2.1810e-01 9.2199e-05 -2.5306e-03 1.1517e-04 2.1059e-04 -6.0000e+00 1.5289e-02 -2.5866e-04 0.0000e+00 12 8 8 10 0 0 84.28 21.25 0.22 -0.00026 -0.01927 88 21 1 5 0 549.990 26.51 20.00 21.25 10.99 35.1 1008.64 -80289 -77698 -130209 343023 900000 -109891 -193716 -153066 900000 -176043 -140882 -147604 900000 -10620 -69855 11555 -76414 107842 900000 -26540 39439 95306 900000 -76730 111533 -4884 -47064 -9429 -106145 71559 40420 73401 11234 65277 -288 17814 -4814 44428 72635 10290 109337 4797 53610 30873 5697 36436 25074 68665 6837 52988 52424 7866 7764 36920 31466 14351 14455 10660 -16065 17193 32470 18443 8553 18004 4217 15141 4592 -4015 1309 8278 11519 5809 3373 -3058 -1373 9681 -6328 1442 9693 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