File name: Pandora30s1_Juelich_20200819_L2Fit_fout2c3d20191023p1-8.txt File generation date: 20251119T154011.3Z 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_20200819_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: 20200819 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 20200819T051610.1Z 7536.219561 75 1 48.18 2 83.63 77.83 83.60 73.23 0.00 1 0.00 1 0 25 8.703e-01 7.425e-02 2.516e-01 1.345e-02 8.678033e-01 7.837064e-03 1.034928e-02 -6.000000e+00 5.161307e-01 231.89 -2.00 3.80 -2.00 321.67 0.00e+00 -1.825741e-02 2.784753e-03 4.327200e-03 -6.000000e+00 2.458367e-02 283.06 -2.00 20.00 -2.00 321.08 0.00e+00 8.124 0.011 302.00 328.00 3 1.3637e+00 2.5079e-02 1.0125e-01 -6.0000e+00 1.2947e+00 1.6406e+00 2.9616e-02 7.4816e-02 -6.0000e+00 1.4005e+00 -1.9321e+00 1.8428e-02 2.4106e-02 -6.0000e+00 8.3080e-01 7.0356e-01 9.8274e-03 1.7677e-02 -6.0000e+00 3.6110e-01 1.6634e-05 2.5960e-04 3.7587e-04 2.0141e-04 -6.0000e+00 2.4433e-02 -4.2539e-04 0.0000e+00 12 9 8 11 32 0 19.05 21.52 0.52 -0.00043 0.00153 35 8 1 5 0 1376.320 26.73 19.99 21.52 22.46 32.9 999.78 900000 150047 -3757 900000 109607 76005 -65764 78435 900000 7126 48338 20383 900000 155676 35488 111153 18652 312507 900000 38578 119075 900000 900000 -24279 217798 900000 18492 322445 -84941 900000 900000 98550 57360 22560 17373 103782 24929 900000 286708 73409 900000 145702 176092 286664 28873 139516 75655 900000 -19092 36904 900000 -25338 2203 206051 97313 56088 65006 99609 -34557 173822 320192 80759 14240 32910 4449 12386 23937 -39390 12140 36160 60380 36199 11126 2622 -20675 140836 -34193 82120 122353 -35270 61434 12562 -8695 15470 25705 9187 49879 30395 14374 -14081 23191 20872 10611 12017 8678 -5046 -2109 5263 -4833 -13561 -5644 4768 11713 -3586 -19443 -9643 -5795 -7347 4491 5591 -2447 -1313 -10890 -3083 7634 -3579 -5064 1347 -1475 5407 9128 3691 5199 6444 8790 3338 -8622 3112 -5976 2047 2208 3506 330 2600 -3016 57 1739 964 144 1422 -5421 -2142 900000 5690 -580 900000 3998 3400 -11384 3995 900000 806 3540 1959 900000 4607 3573 5814 2341 4086 900000 3770 4835 900000 900000 -4064 3956 900000 2202 4216 -19271 900000 900000 4510 4066 2267 1650 4071 2145 900000 3749 6517 900000 7304 6268 3749 3597 5676 5551 900000 -3429 4209 900000 -6138 435 5988 8837 7604 8642 8973 -10274 6551 4187 7510 2715 5730 1053 2608 4465 -14612 3033 8088 12019 8819 3323 774 -6759 8991 -10613 8770 10044 -15778 12898 4651 -4338 6420 10225 4533 16958 12614 6806 -8334 8794 7728 4374 5351 4647 -3451 -1627 4298 -4648 -13885 -4875 3289 7441 -2635 -18051 -8549 -5274 -7431 4599 6525 -3300 -1852 -17028 -4333 9719 -4784 -7108 1876 -2226 7659 12569 5109 6890 8203 10621 4112 -12120 4391 -10308 3713 4398 7391 737 6148 -8080 152 4659 2612 381 3466 -13053 -4698 SS 20200819T052554.4Z 7536.226324 78 1 48.83 2 82.12 79.68 82.20 75.01 0.00 1 0.00 1 0 17 6.083e-01 2.582e-02 1.926e-01 4.587e-03 7.814431e-01 2.583970e-03 9.517380e-03 -6.000000e+00 3.561072e-01 231.88 -2.00 3.80 -2.00 321.73 0.00e+00 4.890778e-03 1.356972e-03 2.326303e-03 -6.000000e+00 1.600640e-02 283.06 -2.00 20.00 -2.00 321.22 0.00e+00 6.801 0.007 302.00 328.00 3 1.2047e+00 9.4560e-03 8.2177e-02 -6.0000e+00 8.9768e-01 6.0319e-01 1.2601e-02 4.7809e-02 -6.0000e+00 9.7178e-01 -9.5418e-01 1.1332e-02 2.5558e-02 -6.0000e+00 5.7433e-01 4.0595e-01 5.3118e-03 8.8841e-03 -6.0000e+00 2.4364e-01 9.1746e-05 -1.2333e-03 1.2559e-04 1.3420e-04 -6.0000e+00 1.6419e-02 -1.0438e-03 0.0000e+00 12 8 8 10 0 0 11.07 21.52 0.32 -0.00104 -0.01031 114 27 1 5 0 424.570 26.73 20.00 21.52 23.30 33.0 999.84 -21069 -86478 -147034 900000 78974 -90399 -192812 -138688 900000 -136076 -144040 -114010 900000 4383 -77263 58536 -61329 26553 900000 -30933 27854 195676 402782 -76173 82381 28857 -29585 33012 -103865 99996 68599 43553 8381 6965 -4233 28861 -1314 83208 92641 23886 138894 30468 58123 46545 12133 56281 27827 98001 -2042 21412 73944 5951 11985 43422 42087 24805 29772 16383 -5624 30497 38693 22994 11834 19890 6882 13727 8556 -3101 3931 13650 16955 7289 4730 1358 -1745 11294 -10163 4332 11596 -8709 7781 409 -5830 303 725 -32 5092 2995 2720 -3525 4316 1387 -2210 -1904 -1164 -3880 -2411 -1077 -3163 -3962 -204 -1216 -295 -3098 -5328 -4463 -2064 -3167 317 734 -823 -382 -1970 -521 121 -455 -1367 555 -313 1656 2900 1932 2636 2336 2700 1286 -149 1095 -419 1154 741 1593 280 559 -644 -252 626 316 -114 48 -1735 -2227 -188 -1722 -5615 900000 353 -1432 -8460 -3775 900000 -3980 -4565 -2872 900000 53 -2668 618 -2392 464 900000 -1031 509 874 1800 -3899 994 606 -998 620 -6709 983 1104 1090 313 280 -179 916 -54 1896 2318 1271 2855 1782 2935 2420 887 2943 1786 3548 -192 1705 4263 689 1427 4075 4206 3043 3532 2176 -889 3259 3914 3017 1995 3507 1457 2660 1738 -742 987 3588 4705 2295 1483 408 -486 2464 -2614 1014 2940 -3273 2927 174 -2890 150 382 -18 2866 1758 1583 -2084 2204 690 -1128 -1047 -740 -3000 -2157 -1010 -3265 -4060 -201 -1073 -241 -2697 -5129 -4504 -2172 -3391 371 979 -1243 -605 -3170 -799 177 -655 -2053 868 -523 2758 4620 2964 3892 3353 3740 1740 -205 1652 -747 2131 1504 3410 647 1293 -1612 -650 1625 828 -294 116 -4228 -5133 SS 20200819T053642.2Z 7536.233822 81 1 48.39 2 80.44 81.73 80.63 76.99 0.00 1 0.00 1 0 17 5.400e-01 1.215e-02 9.171e-02 2.085e-03 6.922675e-01 1.143973e-03 8.489992e-03 -6.000000e+00 3.147326e-01 231.88 -2.00 3.80 -2.00 321.25 0.00e+00 2.981360e-03 5.451973e-04 2.172621e-03 -6.000000e+00 1.370865e-02 283.06 -2.00 20.00 -2.00 320.70 0.00e+00 5.737 0.004 302.00 328.00 3 1.0437e+00 3.8901e-03 7.0299e-02 -6.0000e+00 7.9187e-01 7.9701e-02 5.3872e-03 4.2657e-02 -6.0000e+00 8.5596e-01 -1.8999e-01 5.4503e-03 2.2922e-02 -6.0000e+00 5.0624e-01 8.1319e-02 2.5870e-03 7.3521e-03 -6.0000e+00 2.1501e-01 3.3856e-04 -8.0467e-04 5.7257e-05 9.5429e-05 -6.0000e+00 1.4365e-02 -1.4754e-03 0.0000e+00 12 8 8 10 0 0 5.57 21.52 0.19 -0.00148 -0.00752 243 57 1 5 0 199.090 26.73 20.00 21.52 24.15 32.8 999.70 -172592 -171649 -206887 -54872 -120876 -221630 -207753 -195470 900000 -182187 -164649 -152262 -4604 -80845 -110996 -49919 -86025 -24516 36461 -61440 -39873 -15537 -2426 -78815 -14413 -23897 -45901 -20320 -85851 -1608 -11707 2741 -10190 -8440 -23064 -5160 -13446 8636 18876 -4827 26159 -12 10555 8040 900 11714 2718 20755 -7402 12771 10947 -69 2436 10785 10483 4205 5938 3203 -1541 5527 6510 6843 5061 6314 1834 3958 2359 -1478 2538 3244 4254 1722 1375 -808 -313 1043 -3661 -987 1972 -2515 846 -398 -3196 -965 -1313 -120 1382 1004 1628 -744 1552 -324 -892 -964 -1074 -1210 -205 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