File name: Pandora141s1_Calakmul_20250111_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250112T061506.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 141 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20250111_L1_smca1c3d20231011p1-8.txt Full location name: Calakmul Atmospheric Observatory Short location name: Calakmul Country of location: Mexico Location latitude [deg]: 18.5956 Location longitude [deg]: -89.4137 Location altitude [m]: 275 Local noon date: 20250111 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: OoB session based on session 2 First and last pixel inside fitting window: 238 379 Nominal wavelengths inside fitting window [nm]: 305.1074 305.2483 305.3892 305.5302 305.6711 305.8120 305.9528 306.0937 306.2346 306.3754 306.5163 306.6571 306.7979 306.9387 307.0795 307.2203 307.3611 307.5018 307.6426 307.7833 307.9240 308.0647 308.2054 308.3461 308.4868 308.6275 308.7681 308.9088 309.0494 309.1900 309.3306 309.4712 309.6118 309.7524 309.8930 310.0335 310.1741 310.3146 310.4551 310.5956 310.7361 310.8766 311.0171 311.1575 311.2980 311.4384 311.5788 311.7192 311.8596 312.0000 312.1404 312.2808 312.4211 312.5615 312.7018 312.8421 312.9824 313.1227 313.2630 313.4033 313.5435 313.6838 313.8240 313.9643 314.1045 314.2447 314.3849 314.5251 314.6652 314.8054 314.9455 315.0857 315.2258 315.3659 315.5060 315.6461 315.7862 315.9262 316.0663 316.2063 316.3463 316.4864 316.6264 316.7664 316.9063 317.0463 317.1863 317.3262 317.4662 317.6061 317.7460 317.8859 318.0258 318.1657 318.3055 318.4454 318.5852 318.7250 318.8649 319.0047 319.1445 319.2842 319.4240 319.5638 319.7035 319.8433 319.9830 320.1227 320.2624 320.4021 320.5418 320.6814 320.8211 320.9607 321.1003 321.2400 321.3796 321.5192 321.6588 321.7983 321.9379 322.0774 322.2170 322.3565 322.4960 322.6355 322.7750 322.9145 323.0539 323.1934 323.3328 323.4723 323.6117 323.7511 323.8905 324.0299 324.1692 324.3086 324.4479 324.5873 324.7266 324.8659 --------------------------------------------------------------------------------------- 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 20250111T133950.2Z 9142.569331 234 1 6.32 2 76.49 118.82 123.99 324.51 0.00 1 0.00 1 0 25 4.511e-01 1.143e-02 2.017e-01 9.311e-03 4.441892e-01 5.030634e-03 4.963786e-03 -6.000000e+00 2.732906e-01 224.55 -2.00 3.11 -2.00 319.55 0.00e+00 1.619801e-03 1.495251e-03 1.894873e-03 -6.000000e+00 1.265727e-02 290.54 -2.00 20.00 -2.00 318.78 0.00e+00 4.178 0.000 302.00 328.00 3 4.0305e+00 1.4357e-02 4.5529e-02 -6.0000e+00 6.7114e-01 1.4853e-02 1.7150e-02 2.2848e-02 -6.0000e+00 7.2352e-01 -1.3588e-02 1.3398e-02 1.1077e-02 -6.0000e+00 4.3421e-01 -7.1254e-04 7.0247e-03 3.0097e-03 -6.0000e+00 1.8948e-01 1.0276e-04 7.8374e-04 2.9742e-04 4.5949e-05 -6.0000e+00 1.4052e-02 -5.3563e-02 2.2613e-04 12 9 9 12 9 1 73.63 19.90 0.28 -0.05356 -0.04767 3 38 1 5 0 1578.700 26.00 20.00 19.90 29.27 35.3 984.73 172209 -91171 67806 -29159 900000 -70680 438636 -33335 6350 141139 -43764 -7828 -36020 55502 -27032 1314 -1855 -398 14847 389 45899 -3774 -7497 -6189 303 6452 -11789 11354 -6999 -8356 -5318 11909 -2069 7757 8502 539 -11862 -3176 -407 -6632 11650 448 -3368 634 -126 772 -2493 -869 653 2945 -3704 2475 2777 2386 864 -3216 3020 -3719 1076 -2535 2557 2752 3336 2070 -237 1765 -457 -1421 698 5068 1087 818 1002 85 1189 653 -283 -2660 1694 -1414 -1822 -2288 -651 1270 -742 1771 -24 -446 -971 43 -59 -1078 -892 -1809 -38 495 -109 -1499 -766 -1128 338 -2168 -291 1082 -1277 -311 -874 34 -108 775 1652 84 1735 669 490 551 -20 -180 -404 -250 -665 783 579 416 -830 -20 665 -86 197 546 286 -367 194 -462 -162 -232 210 -296 450 -474 -467 285 1563 -3523 618 -653 900000 -2150 3981 -850 124 1281 -1545 -215 -1503 1181 -1481 63 -101 -23 793 25 1988 -265 -562 -489 24 508 -1112 844 -608 -758 -516 1114 -244 875 942 65 -1726 -498 -74 -1472 2426 110 -895 166 -34 207 -695 -241 182 838 -1197 820 987 903 346 -1380 1253 -1638 451 -1095 1092 1257 1654 1108 -132 950 -243 -770 398 3065 731 572 700 58 756 387 -159 -1513 988 -943 -1357 -1872 -561 1134 -708 1741 -25 -476 -1038 44 -58 -1020 -808 -1661 -37 517 -125 -1880 -1001 -1479 421 -2600 -332 1237 -1551 -392 -1151 47 -156 1175 2606 137 2772 1043 734 804 -29 -271 -634 -405 -1088 1257 913 640 -1257 -30 953 -127 304 895 492 -654 355 -877 -318 -471 434 -620 938 -978 -940 555 SS 20250111T135037.2Z 9142.576819 237 1 59.96 2 74.27 120.01 125.35 326.70 0.00 1 0.00 1 0 25 1.890e-02 4.838e-03 5.669e-03 5.337e-04 3.859026e-01 2.853944e-04 4.131004e-03 -6.000000e+00 1.141927e-02 224.55 -2.00 3.11 -2.00 319.09 0.00e+00 7.602087e-04 7.183439e-05 3.947084e-04 -6.000000e+00 5.212871e-04 290.54 -2.00 20.00 -2.00 318.28 0.00e+00 3.622 0.000 302.00 328.00 3 1.4533e+00 7.8934e-04 3.8995e-02 -6.0000e+00 2.8060e-02 -2.3175e-02 9.1928e-04 1.7893e-02 -6.0000e+00 3.0263e-02 1.5342e-02 6.6430e-04 8.8763e-03 -6.0000e+00 1.8169e-02 -1.2766e-02 3.5110e-04 2.5807e-03 -6.0000e+00 7.9145e-03 2.4651e-03 -5.1387e-04 1.7177e-05 3.3501e-05 -6.0000e+00 5.8328e-04 -5.0014e-02 -4.7303e-05 11 1 0 11 8 0 99.72 19.91 0.15 -0.05001 -0.05387 947 947 1 5 0 63.300 26.11 20.01 19.91 29.80 35.3 984.98 -3714 -7073 -2182 -9042 -2581 -10163 -2237 -5731 -5263 -3441 -4431 -2813 -4993 89 -2617 315 -1567 -348 188 -170 905 -699 1902 -519 796 -441 -919 -1391 -1028 -198 -267 2313 -187 -479 -2823 -2581 -2302 -911 -346 -1015 -1026 -1326 -665 -965 -236 -396 -709 -657 -551 234 262 979 697 715 417 686 540 -95 179 362 1190 1579 2154 1463 636 272 -65 684 1114 1296 581 402 329 91 134 -346 -503 -835 -650 -902 -1054 -1693 -1803 -1580 -978 -367 -90 275 155 472 481 410 303 461 543 501 570 222 -27 -322 -645 -751 -121 -116 -761 -809 -840 -272 192 553 431 187 92 35 238 433 595 473 148 -286 -272 -150 -90 76 62 112 487 623 326 114 -233 -369 -162 26 -115 -127 127 -45 22 -53 -62 -81 -93 -206 -63 -272 -68 -280 -61 -182 -186 -127 -173 -116 -244 5 -175 23 -128 -30 17 -16 88 -70 192 -57 93 -55 -115 -169 -121 -24 -34 327 -30 -73 -471 -430 -383 -176 -80 -275 -309 -427 -221 -329 -81 -136 -245 -227 -192 84 100 404 287 313 192 325 262 -46 86 173 587 838 1245 913 407 168 -38 405 708 919 420 305 249 66 98 -231 -312 -509 -422 -663 -818 -1472 -1697 -1474 -969 -385 -100 311 175 515 491 416 290 439 554 532 678 274 -36 -425 -805 -926 -141 -139 -970 -1028 -1126 -382 271 838 696 309 149 55 343 632 867 718 225 -457 -443 -240 -139 113 94 163 686 896 505 181 -395 -652 -280 46 -220 -242 248 -90 44 -104 -122 -155 SS 20250111T140050.9Z 9142.583922 240 1 59.57 2 72.18 121.20 126.57 328.88 0.00 1 0.00 1 0 25 4.735e-02 7.983e-03 3.905e-02 4.655e-03 3.448728e-01 2.482556e-03 3.775513e-03 -6.000000e+00 2.860526e-02 224.55 -2.00 3.11 -2.00 318.97 0.00e+00 8.296015e-04 5.940734e-04 8.021370e-04 -6.000000e+00 1.306064e-03 290.54 -2.00 20.00 -2.00 318.15 0.00e+00 3.223 0.000 302.00 328.00 3 5.5312e+00 6.8263e-03 3.4837e-02 -6.0000e+00 7.0289e-02 6.3077e-02 7.9053e-03 1.6426e-02 -6.0000e+00 7.5815e-02 1.1908e-02 5.4843e-03 7.9835e-03 -6.0000e+00 4.5515e-02 -1.3076e-02 2.8863e-03 2.2483e-03 -6.0000e+00 1.9823e-02 6.0735e-05 -7.1896e-04 1.5237e-04 2.9650e-05 -6.0000e+00 1.4615e-03 -4.9380e-02 -8.3290e-05 11 9 0 11 8 0 99.91 19.91 0.31 -0.04938 -0.05478 31 31 1 5 0 1921.190 26.00 20.00 19.91 30.26 35.4 985.17 -17857 23244 -13934 -1177 -15415 22296 -227 -8328 4845 3592 -4950 -14558 -4277 2769 2687 5874 -11475 -119 -8667 2606 -12191 -2134 421 3325 -4651 4301 2257 1331 124 -2943 9258 -5466 3043 765 -6242 429 -7689 5511 -2661 2265 -265 -1012 -1498 -2401 1735 -3061 2168 36 3333 429 194 -614 857 3199 825 924 -1310 673 -692 898 -86 2187 1877 1182 2218 -841 971 -1993 2103 2828 1031 831 685 664 -1185 402 -1491 -237 -1799 -846 -1846 -1964 -1272 -1661 -385 -942 144 717 547 -36 288 250 -603 511 -1158 891 41 142 216 28 -807 -2093 -53 -681 -516 -1147 -781 -474 465 1315 464 658 -75 406 245 248 224 -100 -55 -48 246 405 460 293 -75 240 -5 476 -351 649 -666 -34 -686 356 -109 -60 391 187 -98 -243 95 -569 -719 709 -623 -45 -630 623 -8 -365 208 165 -254 -867 -262 186 208 494 -1223 -12 -999 281 -1554 -250 50 403 -646 571 305 176 16 -395 1186 -889 496 132 -1124 73 -1517 1119 -690 645 -85 -346 -534 -878 614 -1137 764 13 1160 158 75 -258 380 1462 400 461 -679 342 -353 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