File name: Pandora162s1_Brussels-Uccle_20231212_L2Fit_fout2c10d20230607p1-8.txt File generation date: 20240410T162736.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c10p1-8 Local principal investigator: Michel Van Roozendael Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 162 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora162_OF_v8d20191031.txt Instrument calibration file used: Pandora162s1_CF_v10d20230607.txt Level 1 file used: Pandora162s1_Brussels-Uccle_20231212_L1_smca1c10d20230607p1-8.txt Full location name: Uccle (BIRA-IASB, KMI-IRM) Short location name: Brussels-Uccle Country of location: Belgium Location latitude [deg]: 50.7980 Location longitude [deg]: 4.3580 Location altitude [m]: 107 Local noon date: 20231212 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: Full lab calibration and analysis after repairs + OoB session First and last pixel inside fitting window: 225 367 Nominal wavelengths inside fitting window [nm]: 305.0216 305.1625 305.3033 305.4442 305.5850 305.7258 305.8666 306.0074 306.1482 306.2890 306.4298 306.5705 306.7113 306.8520 306.9927 307.1334 307.2741 307.4148 307.5555 307.6961 307.8368 307.9774 308.1181 308.2587 308.3993 308.5399 308.6804 308.8210 308.9616 309.1021 309.2426 309.3832 309.5237 309.6642 309.8047 309.9451 310.0856 310.2260 310.3665 310.5069 310.6473 310.7877 310.9281 311.0685 311.2089 311.3492 311.4896 311.6299 311.7702 311.9105 312.0508 312.1911 312.3314 312.4717 312.6119 312.7522 312.8924 313.0326 313.1728 313.3130 313.4532 313.5933 313.7335 313.8736 314.0138 314.1539 314.2940 314.4341 314.5742 314.7143 314.8543 314.9944 315.1344 315.2744 315.4145 315.5545 315.6945 315.8344 315.9744 316.1144 316.2543 316.3942 316.5342 316.6741 316.8140 316.9538 317.0937 317.2336 317.3734 317.5133 317.6531 317.7929 317.9327 318.0725 318.2123 318.3520 318.4918 318.6315 318.7713 318.9110 319.0507 319.1904 319.3301 319.4697 319.6094 319.7490 319.8887 320.0283 320.1679 320.3075 320.4471 320.5867 320.7262 320.8658 321.0053 321.1448 321.2843 321.4238 321.5633 321.7028 321.8423 321.9817 322.1212 322.2606 322.4000 322.5394 322.6788 322.8182 322.9576 323.0969 323.2363 323.3756 323.5149 323.6542 323.7935 323.9328 324.0721 324.2114 324.3506 324.4899 324.6291 324.7683 324.9075 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20231212T102523.3Z 8746.434298 159 1 2.67 2 75.50 163.22 78.45 171.18 0.00 1 0.00 1 0 17 1.328e-01 8.763e-03 1.409e-01 6.561e-03 5.501522e-01 3.328136e-03 6.899631e-03 -6.000000e+00 7.541788e-02 220.59 -2.00 3.79 -2.00 319.64 0.00e+00 3.394163e-03 9.544806e-04 3.309881e-04 -6.000000e+00 3.232464e-03 269.30 -2.00 20.00 -2.00 319.22 0.00e+00 3.913 0.001 302.00 328.00 3 2.1223e+00 9.2419e-03 4.8493e-02 -6.0000e+00 1.8519e-01 1.2445e-01 1.1010e-02 3.0131e-02 -6.0000e+00 2.0192e-01 -5.8486e-02 9.9249e-03 1.6046e-02 -6.0000e+00 1.2002e-01 9.9731e-03 5.2854e-03 6.5770e-03 -6.0000e+00 5.1279e-02 6.8989e-04 9.2252e-05 1.8516e-04 6.4912e-05 -6.0000e+00 3.7469e-03 -1.3095e-02 0.0000e+00 12 9 1 12 1 1 97.95 18.40 0.19 -0.01310 -0.01240 4 20 4 8 0 490.210 15.04 18.40 16.67 20.87 21.38 1.5 928.80 -70404 -36752 -53933 -47910 22663 -23689 -20597 -29289 5797 -47934 -23603 -62577 3848 23555 -25656 -13271 -15382 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553 -783 -336 -315 -719 -576 48 1359 647 1674 140 -143 266 977 -684 -815 -769 -2030 1494 1792 -860 -2535 -427 -1056 -1053 -248 -491 -917 -334 120 177 480 1588 1960 1165 -66 -1324 183 840 1125 -265 210 1093 2432 1417 -480 -573 -16 -1055 -494 630 11 -619 1321 282 -1070 -455 -196 -879 SS 20231212T140830.8Z 8746.589245 273 1 49.93 2 81.15 215.04 87.56 218.46 0.00 1 0.00 1 0 17 5.737e-01 9.650e-03 2.765e-01 4.432e-03 8.373847e-01 2.438512e-03 9.833778e-03 -6.000000e+00 3.271960e-01 220.58 -2.00 3.79 -2.00 321.54 0.00e+00 8.989779e-03 1.158965e-03 1.859356e-03 -6.000000e+00 1.531856e-02 269.29 -2.00 20.00 -2.00 321.16 0.00e+00 6.154 0.005 302.00 328.00 3 1.5621e+00 8.0222e-03 7.8499e-02 -6.0000e+00 8.0311e-01 3.2465e-01 1.2494e-02 5.5262e-02 -6.0000e+00 8.7622e-01 -2.8379e-01 1.5021e-02 3.0143e-02 -6.0000e+00 5.1967e-01 9.9062e-02 7.1112e-03 1.7024e-02 -6.0000e+00 2.2389e-01 1.0718e-04 7.1101e-05 1.2168e-04 1.6866e-04 -6.0000e+00 1.6320e-02 -1.3082e-02 0.0000e+00 12 8 8 10 0 0 99.97 18.42 0.60 -0.01308 -0.01255 76 15 4 8 0 656.770 15.03 18.42 18.56 20.87 21.38 1.4 941.86 -251334 900000 -217915 -97665 -195896 900000 -236571 -204517 20071 -232869 900000 -208937 900000 -172436 -52137 -73555 45406 -25272 -44113 -31901 -87028 61946 -54844 22449 -13204 -6953 -55434 33195 -78890 -36273 -23054 -35634 -20190 150 25942 -64177 -11381 -6897 -6264 -20037 -3320 -10290 -48 9427 4756 20911 -601 -9316 8344 4733 708 2974 8071 4499 3370 7526 5040 -3086 -2356 -144 9708 -3164 6707 6512 1080 10793 3379 3021 4250 4567 -13 2015 1042 905 -4799 -1815 17669 64 1400 -1540 -981 -348 -2058 -1868 437 -1171 -37 433 181 -79 262 1519 -1474 486 511 54 -420 397 -355 -567 -17 -30 425 699 -685 -1752 -1003 -460 -1493 497 -577 -596 -810 -214 -252 858 508 796 703 307 -626 360 1266 -19 -175 70 114 1941 809 -24 -207 -175 -220 -61 -34 100 -453 639 -2 -450 82 -121 -213 -1751 900000 -1578 -422 -1111 900000 -1967 -1347 87 -2434 900000 -2140 900000 -2273 -286 -644 196 -191 -449 -308 -1489 268 -699 143 -128 -67 -881 223 -1612 -546 -377 -836 -494 3 462 -2660 -300 -200 -218 -952 -155 -561 -3 480 260 1018 -38 -673 549 352 61 285 823 520 423 950 669 -443 -328 -19 1196 -479 1062 1193 230 2163 731 682 1034 1263 -4 670 349 288 -1478 -490 3709 16 388 -521 -393 -160 -1072 -1039 251 -721 -23 283 120 -51 159 865 -837 279 327 40 -365 392 -390 -645 -19 -30 383 601 -619 -1684 -1003 -489 -1740 637 -831 -928 -1303 -341 -390 1271 752 1209 1113 502 -1025 564 1891 -27 -249 97 155 2652 1234 -42 -395 -358 -475 -139 -82 249 -1153 1628 -5 -1128 195 -271 -459 SS 20231212T143354.6Z 8746.606882 285 1 50.33 2 83.60 220.39 90.12 223.28 0.00 1 0.00 1 0 25 7.926e-01 1.533e-02 4.283e-01 8.522e-03 1.046687e+00 5.072104e-03 1.178594e-02 -6.000000e+00 4.593154e-01 220.58 -2.00 3.79 -2.00 322.28 0.00e+00 9.794714e-03 2.778060e-03 7.389858e-03 -6.000000e+00 2.304193e-02 269.28 -2.00 20.00 -2.00 321.92 0.00e+00 8.127 0.011 302.00 328.00 3 4.1900e-01 1.8731e-02 1.1483e-01 -6.0000e+00 1.1306e+00 7.8264e-01 3.2946e-02 1.0413e-01 -6.0000e+00 1.2379e+00 -8.2973e-01 4.0094e-02 4.3662e-02 -6.0000e+00 7.3123e-01 3.0391e-01 1.8040e-02 1.9141e-02 -6.0000e+00 3.1887e-01 4.1887e-05 4.1269e-04 2.3534e-04 2.1143e-04 -6.0000e+00 2.3028e-02 -1.6090e-02 0.0000e+00 12 8 8 10 0 0 99.65 18.43 0.68 -0.01609 -0.01299 62 12 4 8 0 811.550 14.98 18.43 18.64 20.87 21.38 1.4 941.91 900000 900000 900000 -293433 -317143 900000 -290130 -296937 900000 -283798 900000 -262841 900000 -97793 254181 900000 -80247 900000 -97964 -176362 -101910 900000 -107437 38147 -79730 -55364 900000 -59971 -94842 23662 -54337 112977 -59811 68323 114504 -115713 -25206 -21537 45557 -49024 21370 -17495 135153 -2126 103449 55442 2106 -39371 48728 43681 37577 45634 -5096 -3456 -8069 52440 13036 4874 -6315 797 23381 -9087 18092 4477 9792 10248 9748 11816 15780 12087 2698 11166 10296 12340 -3862 11040 74570 1070 52 -7641 -2286 2652 1072 961 2007 3234 3262 2507 995 -653 3452 2479 184 -1151 -1767 -1256 -747 1366 -1651 -92 -1409 -1227 1530 1245 271 -2070 -778 -1991 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