File name: Pandora162s1_Brussels-Uccle_20231231_L2Fit_fout2c13d20231120p1-8.txt File generation date: 20240912T122356.5Z 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_20231231_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: 20231231 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 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-1284 5987 -1598 6609 5510 8085 1810 1218 2469 122 -2080 4456 3734 -3935 5008 -2008 2841 -747 4892 -173 -965 2060 3399 -996 -9482 3270 1500 1131 -1122 2781 -1096 875 -515 -846 959 -4769 1602 -3862 487 -220 1759 1858 -1986 1797 -3584 146 -2214 2322 969 3513 -1644 -4966 -7123 -924 1641 -3833 3383 -3989 -161 -5383 1019 -2009 1617 2872 -1361 392 3372 3371 -4067 7718 -1121 2019 836 2794 4661 1504 2228 -1157 -5668 2743 692 -560 -108 4438 1100 814 -8570 -3050 575 3865 -5626 5515 66 -1660 SS 20231231T113400.2Z 8765.481947 378 1 52.09 2 73.94 177.26 98.90 306.19 0.00 1 0.00 1 0 17 1.035e-01 5.040e-03 3.390e-02 1.147e-03 5.424368e-01 5.858580e-04 6.698025e-03 -6.000000e+00 5.765744e-02 221.23 -2.00 3.79 -2.00 320.36 0.00e+00 2.061954e-03 1.989839e-04 4.296425e-04 -6.000000e+00 2.441915e-03 268.01 -2.00 20.00 -2.00 319.95 0.00e+00 3.555 0.001 302.00 328.00 3 1.5563e+00 1.6855e-03 4.5629e-02 -6.0000e+00 1.4191e-01 8.8362e-02 2.1023e-03 2.9837e-02 -6.0000e+00 1.5482e-01 -2.9850e-02 2.1189e-03 1.6345e-02 -6.0000e+00 9.1878e-02 -1.8420e-03 1.1033e-03 6.1460e-03 -6.0000e+00 3.9479e-02 1.7325e-03 1.2981e-04 3.2678e-05 6.0697e-05 -6.0000e+00 2.7336e-03 5.5807e-03 0.0000e+00 10 0 0 10 0 0 99.99 18.42 0.31 0.00558 0.00656 417 84 2 8 0 119.710 14.95 18.42 13.81 20.87 21.38 1.6 909.32 -32095 -38500 -39697 -14689 -49372 -37873 -46398 -28760 -28123 -10975 -24474 -20893 -22332 -14807 -10700 -4663 -976 -12051 -5788 -3569 128 -4106 -438 -1455 -4450 -3991 -5750 -11381 -7559 -2069 -5229 1412 1090 108 -3019 -3943 -3441 -2275 -1319 -1269 -490 -2132 -1589 -1213 7 -38 16 1168 -437 -624 467 1255 1378 1658 822 1136 722 17 202 322 1165 1345 2456 2158 1415 -81 621 -768 103 1727 698 1035 158 478 47 219 -471 -868 -756 -76 -786 -889 -1632 -1993 -1148 -976 -61 78 605 746 479 867 9 136 278 275 15 910 691 62 -147 -607 -462 108 77 -1369 -828 -818 -562 42 18 136 -95 -50 -249 68 511 519 430 359 -124 34 409 387 246 481 -386 645 707 -166 -12 -437 -342 -378 -76 21 -306 478 252 -34 -24 -70 -318 -262 -400 -457 -131 -569 -368 -519 -306 -340 -123 -326 -287 -377 -293 -254 -125 -28 -430 -210 -134 5 -161 -17 -61 -210 -200 -302 -616 -378 -100 -297 88 79 8 -245 -309 -286 -198 -139 -162 -71 -338 -264 -207 1 -7 3 206 -80 -120 96 285 342 444 236 337 222 5 61 95 345 428 867 858 606 -35 251 -314 44 836 383 599 93 268 25 102 -201 -360 -333 -38 -468 -604 -1234 -1602 -971 -880 -58 76 592 710 428 714 7 104 227 256 16 1094 844 78 -191 -723 -496 112 85 -1644 -1036 -1083 -797 60 27 226 -160 -81 -378 96 709 743 651 575 -203 55 623 569 378 709 -548 902 1077 -261 -21 -805 -654 -755 -161 47 -710 1120 596 -78 -53 -145 -630 SS 20231231T113957.8Z 8765.486085 381 1 4.92 2 73.90 178.69 99.65 307.38 0.00 1 0.00 1 0 17 1.183e-01 6.970e-03 1.216e-01 4.313e-03 5.456405e-01 2.162357e-03 6.823630e-03 -6.000000e+00 6.588562e-02 221.23 -2.00 3.79 -2.00 319.70 0.00e+00 8.766547e-04 6.195919e-04 3.631109e-04 -6.000000e+00 2.790431e-03 268.01 -2.00 20.00 -2.00 319.29 0.00e+00 3.548 0.001 302.00 328.00 3 2.4362e+00 6.0229e-03 4.5599e-02 -6.0000e+00 1.6217e-01 9.8266e-02 7.2143e-03 2.9666e-02 -6.0000e+00 1.7692e-01 -3.8059e-02 6.6765e-03 1.5637e-02 -6.0000e+00 1.0499e-01 3.1554e-03 3.5644e-03 5.1409e-03 -6.0000e+00 4.5112e-02 7.1925e-04 2.6125e-04 1.1836e-04 5.2858e-05 -6.0000e+00 3.1238e-03 5.7301e-03 0.0000e+00 12 9 1 12 1 1 99.93 18.40 0.36 0.00573 0.00769 11 27 1 8 0 369.400 14.93 18.40 13.99 20.87 21.38 1.6 912.16 -10841 -7327 80818 751 -8795 -61752 -45249 -42610 9949 -37029 -27807 -19207 -22946 -9766 -9185 -3980 -21679 -439 -9028 -917 -8852 10362 -2081 1399 -5339 -2364 653 -4619 -6771 -7361 8082 -1658 6252 -245 -4010 -8055 -3710 -2263 98 -2900 -645 1279 -3908 306 -1393 -1488 -2199 -27 -1186 -1140 2218 1693 2006 253 1080 615 1950 1006 -372 1228 774 3136 768 3636 778 -728 -138 1458 1310 1127 235 996 291 -159 511 -1132 -252 -513 217 -1701 272 -577 -1358 -2175 -2052 -1127 -1051 524 879 1147 500 816 -26 72 1067 112 52 502 872 -101 126 -924 -761 246 -460 -1180 -1086 -637 -968 -2 6 308 -136 330 -82 -569 232 285 870 120 -45 117 239 300 457 1148 -124 704 857 -47 -264 -560 -220 -465 208 -73 -156 85 799 -28 -56 -340 -625 -103 -80 397 8 -96 -1082 -714 -747 119 -779 -556 -377 -563 -264 -306 -151 -1017 -20 -441 -44 -473 494 -115 81 -335 -154 42 -308 -440 -532 567 -139 558 -26 -426 -852 -401 -281 15 -539 -134 281 -952 74 -342 -371 -559 -7 -310 -311 635 504 650 90 407 242 783 411 -150 474 303 1288 362 1868 410 -381 -74 764 731 673 158 707 209 -110 325 -656 -141 -278 124 -1071 196 -448 -1173 -2007 -2006 -1098 -1080 549 924 1170 481 768 -23 63 991 113 59 617 1179 -133 166 -1121 -881 275 -552 -1436 -1382 -855 -1325 -3 9 509 -228 531 -130 -856 338 430 1377 192 -72 184 382 462 673 1610 -177 996 1250 -77 -453 -976 -397 -882 397 -147 -326 181 1695 -59 -111 -665 -1174 SS 20231231T133950.0Z 8765.569329 443 1 4.98 2 78.08 206.74 111.65 333.72 0.00 1 0.00 1 0 25 4.799e-01 1.084e-02 3.538e-01 1.002e-02 7.084044e-01 5.314106e-03 8.510827e-03 -6.000000e+00 2.707497e-01 221.24 -2.00 3.79 -2.00 320.89 0.00e+00 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