File name: Pandora84s1_Rotterdam-Haven_20240710_L2Fit_fout2c5d20240501p1-8.txt File generation date: 20250501T134423.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Alexander Cede Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 84 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora84_OF_v3d20231130.txt Instrument calibration file used: Pandora84s1_CF_v5d20240501.txt Level 1 file used: Pandora84s1_Rotterdam-Haven_20240710_L1_smca1c5d20240501p1-8.txt Full location name: De Slufter Visitor Centre Short location name: Rotterdam-Haven Country of location: Netherlands Location latitude [deg]: 51.9335 Location longitude [deg]: 3.9998 Location altitude [m]: 0 Local noon date: 20240710 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: Based on OoB session 2 for fieldcal First and last pixel inside fitting window: 197 339 Nominal wavelengths inside fitting window [nm]: 305.0824 305.2233 305.3642 305.5050 305.6459 305.7867 305.9276 306.0684 306.2092 306.3500 306.4908 306.6316 306.7724 306.9131 307.0539 307.1946 307.3353 307.4760 307.6167 307.7574 307.8981 308.0388 308.1794 308.3201 308.4607 308.6014 308.7420 308.8826 309.0232 309.1638 309.3043 309.4449 309.5854 309.7260 309.8665 310.0070 310.1475 310.2880 310.4285 310.5690 310.7095 310.8499 310.9904 311.1308 311.2712 311.4116 311.5520 311.6924 311.8328 311.9731 312.1135 312.2538 312.3942 312.5345 312.6748 312.8151 312.9554 313.0957 313.2359 313.3762 313.5164 313.6567 313.7969 313.9371 314.0773 314.2175 314.3577 314.4978 314.6380 314.7781 314.9183 315.0584 315.1985 315.3386 315.4787 315.6188 315.7588 315.8989 316.0389 316.1790 316.3190 316.4590 316.5990 316.7390 316.8790 317.0189 317.1589 317.2988 317.4388 317.5787 317.7186 317.8585 317.9984 318.1383 318.2781 318.4180 318.5578 318.6977 318.8375 318.9773 319.1171 319.2569 319.3967 319.5364 319.6762 319.8159 319.9556 320.0954 320.2351 320.3748 320.5145 320.6541 320.7938 320.9335 321.0731 321.2127 321.3524 321.4920 321.6316 321.7711 321.9107 322.0503 322.1898 322.3294 322.4689 322.6084 322.7479 322.8874 323.0269 323.1664 323.3058 323.4453 323.5847 323.7242 323.8636 324.0030 324.1424 324.2818 324.4211 324.5605 324.6998 324.8392 324.9785 --------------------------------------------------------------------------------------- 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 20240710T050927.8Z 8957.214905 101 1 54.44 2 78.59 68.50 112.81 31.46 0.00 1 0.00 1 0 17 5.182e-01 9.340e-03 1.413e-01 1.581e-03 7.370585e-01 8.558677e-04 8.965720e-03 -6.000000e+00 3.052222e-01 233.92 -2.00 3.84 -2.00 320.80 0.00e+00 1.629578e-03 3.718262e-04 2.353492e-03 -6.000000e+00 1.323504e-02 282.97 -2.00 20.00 -2.00 320.20 0.00e+00 4.883 0.002 302.00 328.00 3 1.4885e+00 2.7194e-03 6.6282e-02 -6.0000e+00 7.6929e-01 5.2513e-02 3.6485e-03 4.5094e-02 -6.0000e+00 8.3274e-01 -8.8197e-02 3.6871e-03 2.2815e-02 -6.0000e+00 4.9367e-01 2.7521e-02 1.7827e-03 6.5411e-03 -6.0000e+00 2.0458e-01 4.1919e-04 -3.4790e-04 4.1962e-05 8.8199e-05 -6.0000e+00 1.4606e-02 7.3312e-03 0.0000e+00 12 8 8 10 0 0 99.83 24.42 0.37 0.00733 0.00472 204 21 1 5 0 266.830 33.00 20.01 24.42 24.07 1.3 965.32 -52771 81295 -204230 -200003 -44643 -208041 -182005 -197827 -169375 -148545 -127050 -176161 -157654 -82616 -77897 -29603 21383 -52873 -36678 -369 -61584 -40410 -25821 -16004 -43405 -44397 -22116 -35526 -25538 -30849 -11797 -17343 -6651 -8230 -13458 -17726 6171 -14451 11533 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1005 1148 739 273 -421 -379 35 199 616 471 20 236 1262 1038 1136 729 -220 303 1422 58 112 -255 -718 -293 -192 -411 -504 914 1051 141 -323 -678 -893 -546 SS 20240710T052032.6Z 8957.222599 104 1 53.32 2 76.99 70.55 111.95 34.14 0.00 1 0.00 1 0 25 5.725e-01 3.348e-02 3.076e-01 1.078e-02 6.682606e-01 6.421240e-03 9.061762e-03 -6.000000e+00 3.582052e-01 233.92 -2.00 3.84 -2.00 321.24 0.00e+00 1.837269e-02 3.142771e-03 3.390339e-03 -6.000000e+00 2.182739e-02 282.97 -2.00 20.00 -2.00 320.66 0.00e+00 4.326 0.002 302.00 328.00 3 4.9580e+00 2.1932e-02 5.9373e-02 -6.0000e+00 9.1484e-01 2.6378e-01 2.9751e-02 4.0087e-02 -6.0000e+00 1.0053e+00 -1.9390e-01 3.0125e-02 2.7442e-02 -6.0000e+00 5.7887e-01 4.7444e-02 1.4229e-02 1.7068e-02 -6.0000e+00 2.4834e-01 2.0072e-05 -2.3607e-03 3.3248e-04 2.2179e-04 -6.0000e+00 1.8323e-02 1.9033e-02 0.0000e+00 12 9 8 11 8 0 99.98 24.46 1.87 0.01903 0.00129 18 2 2 5 0 2961.910 33.00 19.99 24.46 24.42 1.3 968.22 900000 900000 900000 900000 900000 900000 900000 900000 -70259 900000 900000 900000 -154933 2861 -9794 900000 900000 -113772 900000 900000 -163318 900000 14330 31995 77994 -24933 46005 -72369 900000 -46437 900000 -3620 900000 900000 53541 5764 900000 -70320 900000 38134 -35729 251675 63825 116882 88880 108821 387441 49243 101208 -36480 51672 26287 14094 6414 39398 23543 7910 23736 14116 -2969 4497 14962 -3335 25596 14158 4898 10861 21938 19831 224 15528 -6823 1372 639 -696 10233 46042 -814 9688 1937 -9481 -13136 -42 -388 -4825 6007 -2216 -5620 661 2972 -1221 -672 581 6260 -2941 -6243 -3173 4779 -1999 3504 -2997 -870 -1557 -2300 -5815 -2316 -2173 2007 300 1808 464 2786 1135 -2211 -845 1473 -4462 1091 2055 -1977 418 3160 475 514 1387 -517 -935 2903 -1450 -428 2888 -96 3659 -1823 983 -1426 -493 -677 1341 -1094 -91 -149 -935 900000 900000 900000 900000 900000 900000 900000 900000 -735 900000 900000 900000 -3095 30 -102 900000 900000 -4437 900000 900000 -12116 900000 177 335 816 -474 481 -2272 900000 -1413 900000 -110 900000 900000 1069 186 900000 -6220 900000 1560 -3364 2633 2805 3180 3348 3529 4054 3194 4130 -6374 4163 3025 1991 1047 4782 3399 1341 3377 2171 -550 828 2802 -862 5543 3570 1327 2761 5187 5312 83 5345 -3013 543 237 -237 2827 8478 -250 3091 796 -5089 -8260 -25 -245 -3397 4022 -1530 -4105 495 2077 -826 -423 351 3753 -2194 -5107 -2930 4646 -2221 3622 -3067 -783 -1437 -2178 -5536 -2243 -2230 2130 357 2373 677 4131 1694 -3270 -1167 1929 -6327 1540 3037 -3123 633 4472 666 691 1772 -649 -1159 3703 -2184 -714 5084 -184 7142 -3660 2045 -3168 -1107 -1544 2958 -2357 -184 -309 -1923 SS 20240710T084008.6Z 8957.361210 172 1 54.35 2 46.86 111.02 88.37 76.39 0.00 1 0.00 1 0 17 1.449e-02 7.370e-03 5.786e-03 2.206e-03 2.353407e-01 1.141330e-03 3.028975e-03 -6.000000e+00 8.539797e-03 233.92 -2.00 3.84 -2.00 316.94 0.00e+00 -1.959069e-04 1.468071e-04 1.659472e-04 -6.000000e+00 3.702022e-04 282.98 -2.00 20.00 -2.00 316.19 0.00e+00 1.460 0.000 302.00 328.00 3 5.7138e+00 3.0302e-03 2.0120e-02 -6.0000e+00 2.1525e-02 3.6537e-02 3.3916e-03 1.3464e-02 -6.0000e+00 2.3296e-02 2.1494e-03 1.9746e-03 6.4822e-03 -6.0000e+00 1.3811e-02 -5.6827e-03 9.2895e-04 1.7647e-03 -6.0000e+00 5.7268e-03 3.0045e-04 1.2074e-04 6.5492e-05 2.0862e-05 -6.0000e+00 4.0840e-04 4.0044e-03 0.0000e+00 11 8 0 10 0 0 100.00 24.67 0.94 0.00400 0.00491 238 25 1 5 0 228.330 33.00 20.00 24.67 25.96 1.2 980.16 4163 717 -569 -5323 -766 -3376 1783 -717 -67 -2505 -1229 -7487 -3423 179 640 -2648 3252 -2310 1556 2875 -768 1360 1593 1199 125 -1615 407 -1716 -889 1171 2690 -526 2577 -1760 -2768 -2576 -1616 -1057 1645 -1231 -1131 -243 229 -330 -60 -573 -478 -325 -375 -1318 947 1563 1185 242 446 971 1353 1320 -27 -195 1795 229 1342 1602 189 -949 -478 222 1020 633 568 946 498 935 263 -161 178 -1611 22 -1615 -1956 -1771 -1894 -1546 -972 -286 -67 110 881 73 26 -1 -390 337 40 -114 573 624 -84 -324 -837 -884 -93 -408 -1074 -998 -1019 -449 210 978 853 647 -5 -310 -305 209 -377 395 293 -113 242 432 248 428 736 154 654 1089 468 477 -197 -336 -229 279 -41 59 276 51 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