File name: Pandora162s1_Brussels-Uccle_20240918_L2Fit_fout2c13d20231120p1-8.txt File generation date: 20240918T234139.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 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_v13d20231120.txt Level 1 file used: Pandora162s1_Brussels-Uccle_20240918_L1_smca1c13d20231120p1-8.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: 20240918 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Based on session 12 for fieldcal First and last pixel inside fitting window: 225 367 Nominal wavelengths inside fitting window [nm]: 305.0129 305.1537 305.2944 305.4352 305.5759 305.7166 305.8573 305.9980 306.1387 306.2793 306.4200 306.5606 306.7012 306.8419 306.9825 307.1231 307.2637 307.4042 307.5448 307.6853 307.8259 307.9664 308.1069 308.2474 308.3879 308.5284 308.6689 308.8093 308.9498 309.0902 309.2306 309.3710 309.5114 309.6518 309.7922 309.9326 310.0729 310.2133 310.3536 310.4939 310.6342 310.7745 310.9148 311.0551 311.1953 311.3356 311.4758 311.6161 311.7563 311.8965 312.0367 312.1769 312.3170 312.4572 312.5973 312.7375 312.8776 313.0177 313.1578 313.2979 313.4380 313.5780 313.7181 313.8581 313.9982 314.1382 314.2782 314.4182 314.5582 314.6982 314.8381 314.9781 315.1180 315.2579 315.3978 315.5378 315.6776 315.8175 315.9574 316.0973 316.2371 316.3769 316.5168 316.6566 316.7964 316.9362 317.0759 317.2157 317.3555 317.4952 317.6349 317.7746 317.9144 318.0541 318.1937 318.3334 318.4731 318.6127 318.7524 318.8920 319.0316 319.1712 319.3108 319.4504 319.5899 319.7295 319.8690 320.0086 320.1481 320.2876 320.4271 320.5666 320.7061 320.8455 320.9850 321.1244 321.2638 321.4033 321.5427 321.6821 321.8214 321.9608 322.1002 322.2395 322.3788 322.5182 322.6575 322.7968 322.9361 323.0753 323.2146 323.3539 323.4931 323.6323 323.7715 323.9108 324.0499 324.1891 324.3283 324.4675 324.6066 324.7457 324.8849 --------------------------------------------------------------------------------------- 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 20240918T100601.1Z 9027.420846 345 1 3.37 2 52.80 151.11 125.50 326.61 0.00 1 0.00 1 0 17 9.653e-03 6.574e-03 3.099e-03 1.645e-03 2.151535e-01 8.406102e-04 2.845190e-03 -6.000000e+00 5.531248e-03 228.22 -2.00 3.79 -2.00 315.91 0.00e+00 2.701059e-04 8.549520e-05 4.061778e-05 -6.000000e+00 2.393038e-04 280.02 -2.00 20.00 -2.00 315.30 0.00e+00 1.650 0.000 302.00 328.00 3 2.7948e+00 2.1767e-03 2.0255e-02 -6.0000e+00 1.3774e-02 -9.3426e-03 2.4200e-03 1.1998e-02 -6.0000e+00 1.4917e-02 2.4052e-04 1.3970e-03 5.8996e-03 -6.0000e+00 8.8682e-03 -3.5356e-03 6.4738e-04 1.6665e-03 -6.0000e+00 3.7983e-03 5.0451e-03 -4.5169e-05 4.6136e-05 2.0252e-05 -6.0000e+00 2.5539e-04 -1.9901e-03 0.0000e+00 12 9 1 12 1 1 99.91 18.60 0.32 -0.00199 -0.00233 16 51 4 8 0 197.810 15.00 18.60 22.57 20.96 21.38 1.3 967.47 -430 -476 -245 -3389 -2963 -2690 -286 655 2009 211 -2339 -2161 -343 634 797 690 -1961 1524 -129 1195 1420 328 54 502 828 154 1325 -607 -118 -528 2140 1142 2694 824 -1747 -1324 -1446 -1089 -698 311 -922 -626 -866 -1098 -1403 -211 -861 -682 -452 -468 521 582 751 904 744 696 1120 456 259 357 214 1403 1212 1757 685 -569 -169 -450 237 877 361 493 484 478 263 84 23 -1038 -212 -268 -1085 -1019 -1686 -2087 -1319 -1007 -520 -39 189 412 174 793 35 351 938 96 496 627 529 -244 -296 -464 -916 -228 245 -1110 -832 -812 -745 93 234 322 74 529 189 361 309 107 252 189 29 -213 99 378 317 882 -112 944 979 529 332 16 -223 -343 104 -210 -421 165 58 -348 -52 -479 -331 -94 -106 -57 -780 -655 -541 -57 144 492 52 -586 -531 -89 185 264 254 -717 551 -49 463 565 131 22 209 363 71 611 -272 -48 -206 833 480 1198 395 -820 -579 -663 -569 -403 197 -618 -441 -631 -815 -1040 -155 -625 -478 -327 -333 377 422 575 727 585 557 911 375 210 285 174 1189 1116 1631 659 -521 -148 -373 198 815 356 489 488 472 261 81 20 -875 -176 -230 -998 -1040 -1774 -2310 -1457 -1196 -624 -49 238 510 212 880 37 367 986 105 566 754 693 -312 -378 -575 -1060 -260 301 -1414 -1105 -1077 -1030 129 343 486 109 732 251 463 383 137 342 264 40 -301 143 527 419 1158 -140 1191 1224 712 452 23 -320 -505 154 -316 -659 263 94 -564 -81 -727 -506 SS 20240918T101110.7Z 9027.424429 348 1 52.33 2 52.41 152.66 125.90 328.04 0.00 1 0.00 1 0 17 6.876e-02 2.025e-02 5.776e-02 1.629e-02 2.162071e-01 8.222487e-03 2.938084e-03 -6.000000e+00 3.939197e-02 228.22 -2.00 3.79 -2.00 317.85 0.00e+00 9.937012e-05 1.300584e-03 3.337760e-04 -6.000000e+00 1.704577e-03 280.02 -2.00 20.00 -2.00 317.14 0.00e+00 1.636 0.000 302.00 328.00 3 5.8434e+00 2.1941e-02 2.0364e-02 -6.0000e+00 9.8097e-02 -6.0962e-02 2.4679e-02 1.2447e-02 -6.0000e+00 1.0624e-01 4.2342e-02 1.5095e-02 6.0745e-03 -6.0000e+00 6.3160e-02 -2.0058e-02 7.5435e-03 1.7608e-03 -6.0000e+00 2.7046e-02 2.4325e-04 9.3296e-05 4.8171e-04 2.0635e-05 -6.0000e+00 1.8193e-03 -5.7984e-04 0.0000e+00 12 8 8 10 0 0 98.83 18.60 1.01 -0.00058 0.00012 2081 417 3 8 0 24.000 15.00 18.60 22.70 21.06 21.38 1.3 969.57 6063 34570 -24533 13182 -19767 7758 -27233 13251 -3342 5588 -3595 10568 9822 -3981 14305 -9012 23142 -8272 11478 -7645 1642 -1346 -11868 9736 -6508 16190 -4532 17912 471 10545 -2941 5528 4054 -2371 487 -2684 4114 -5870 7741 -4627 -1429 -5027 -2072 -2277 956 -305 -1215 62 -3046 4926 -2685 6094 978 4312 -789 -2435 1550 -1147 4226 -2456 4622 -1127 4302 -1358 2543 -1857 922 2758 174 3785 -3824 700 -1540 1796 -2756 2366 1335 2907 2204 -1171 2101 -3090 208 -3108 645 -2749 -628 -2220 -1224 -962 968 3534 -1313 5664 -325 4137 -966 1968 686 178 -716 211 840 -144 1934 -2974 752 -2433 563 -626 -1009 -863 -721 -317 -1391 2674 -533 1538 -1606 1231 -887 735 -165 -1715 2385 -284 3070 -927 3808 -332 2001 249 48 -487 -251 1477 -1515 1734 -580 -65 -1830 -456 126 572 2813 -3507 1304 -2367 676 -3335 1247 -409 677 -473 1212 1224 -630 2159 -1851 3740 -1815 2197 -1795 366 -308 -2999 2116 -1733 3659 -1258 3899 112 2189 -707 1314 1045 -684 132 -707 1070 -1892 2610 -2045 -681 -2612 -1080 -1209 492 -160 -634 31 -1532 2282 -1372 3066 545 2446 -487 -1559 975 -746 2585 -1578 2836 -769 3018 -1074 1982 -1427 634 1770 117 2734 -3292 612 -1403 1555 -2377 1780 915 1822 1389 -832 1623 -2767 194 -3127 663 -3138 -748 -2791 -1548 -1197 1114 3652 -1296 4922 -303 4012 -1082 2364 902 238 -925 251 931 -160 2272 -3929 1001 -3483 816 -971 -1656 -1456 -1193 -493 -2012 3456 -689 2002 -2284 1839 -1411 1163 -258 -2647 3368 -392 3916 -1193 4870 -472 2939 384 76 -786 -426 2614 -2852 3240 -1130 -126 -3481 -828 222 SS 20240918T101741.4Z 9027.428951 351 1 1.91 2 51.96 154.64 126.37 329.88 0.00 1 0.00 1 0 17 9.853e-03 6.772e-03 3.361e-03 1.873e-03 2.113527e-01 9.564982e-04 2.782363e-03 -6.000000e+00 5.645484e-03 228.22 -2.00 3.79 -2.00 315.76 0.00e+00 1.510058e-04 9.421705e-05 5.368106e-05 -6.000000e+00 2.442606e-04 280.02 -2.00 20.00 -2.00 315.16 0.00e+00 1.619 0.000 302.00 328.00 3 2.5335e+00 2.4729e-03 1.9857e-02 -6.0000e+00 1.4059e-02 -1.5143e-02 2.7510e-03 1.1734e-02 -6.0000e+00 1.5226e-02 -1.1761e-03 1.5821e-03 5.7674e-03 -6.0000e+00 9.0515e-03 -2.5686e-03 7.2619e-04 1.6214e-03 -6.0000e+00 3.8766e-03 6.8200e-03 -6.1873e-05 5.2452e-05 1.9809e-05 -6.0000e+00 2.6069e-04 -1.5282e-03 0.0000e+00 12 9 1 12 1 1 99.90 18.59 0.34 -0.00153 -0.00199 12 69 2 8 0 145.740 14.98 18.59 22.87 20.96 21.27 1.3 970.20 -378 118 -659 -2386 -3369 -2608 132 -373 2561 -188 -407 -1918 -22 -18 174 1117 -886 777 -652 2122 -167 1383 330 517 401 686 313 -1363 -590 -477 2483 1277 3119 1217 -2237 -2538 -1838 -1205 -486 32 -446 -1133 -899 -768 -747 -205 -924 -788 -989 -848 972 927 494 1088 866 493 1384 747 106 706 900 923 1214 1635 547 -95 -285 -675 112 1441 16 494 162 89 574 -237 -214 -466 282 -207 -1134 -690 -1808 -2200 -1224 -879 -742 109 268 171 263 812 200 389 788 -113 151 618 354 -447 -228 -427 -692 -278 -357 -1140 -466 -633 -922 149 -3 468 117 389 56 378 387 400 489 280 -61 -178 323 120 301 1023 76 997 1006 445 205 -42 -374 -172 79 -48 -566 366 40 -384 -85 -418 -544 -84 29 -170 -601 -756 -579 29 -84 631 -51 -110 -518 -6 -6 59 413 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