File name: Pandora141s1_Calakmul_20250119_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250120T061519.1Z 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 v1.8.70 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20250119_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: 20250119 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 20250119T140746.4Z 9150.588732 312 1 60.66 2 70.60 120.31 60.85 255.57 0.00 1 0.00 1 0 25 7.362e-02 1.471e-02 7.040e-02 1.216e-02 3.155904e-01 6.467258e-03 3.522775e-03 -6.000000e+00 4.452168e-02 224.55 -2.00 3.11 -2.00 318.52 0.00e+00 9.306804e-04 1.336573e-03 9.108571e-04 -6.000000e+00 2.029847e-03 290.46 -2.00 20.00 -2.00 317.69 0.00e+00 2.976 0.000 302.00 328.00 3 6.8933e+00 1.7424e-02 3.2117e-02 -6.0000e+00 1.0941e-01 1.6158e-01 1.9937e-02 1.5105e-02 -6.0000e+00 1.1797e-01 4.9219e-03 1.3017e-02 7.2812e-03 -6.0000e+00 7.0825e-02 -7.5739e-03 6.7659e-03 2.0411e-03 -6.0000e+00 3.0866e-02 1.9399e-05 -7.1572e-05 3.9745e-04 2.6552e-05 -6.0000e+00 2.2713e-03 -4.8370e-02 2.0498e-04 12 8 8 10 0 0 99.87 19.90 1.02 -0.04837 -0.04891 23 23 1 5 0 2636.980 26.11 19.99 19.90 31.87 36.3 984.36 -3753 -24774 29087 -20018 -30996 -3308 28708 -9008 -5744 2210 -30071 -14782 -9657 18709 7083 15957 -12592 3560 -11576 6344 9868 -4609 1816 -6842 20873 -878 -2252 -2645 6330 8016 1282 12764 7205 -2393 -4274 -7286 -980 105 -327 7103 -3513 -1187 3351 1511 1603 -3020 585 -1464 -2311 1129 -1096 885 1145 -2564 -973 246 -219 1215 -2353 1624 1007 2102 2883 3281 -743 -691 897 60 -2484 3465 1152 2044 4834 -240 13 -1615 -151 -1532 732 -2247 -100 -2730 -1085 -1963 -2030 599 993 613 -757 299 -736 1642 -2612 -1126 -1822 240 -76 931 -5 985 -1047 8 -809 -1483 -2015 -175 -3129 367 -291 3183 784 899 1268 -715 -919 -271 -1153 516 -970 520 301 416 2743 1314 -1134 338 823 -599 -129 257 -1345 -450 1706 -192 5 -541 1041 1031 -780 -958 -591 -173 -203 -1795 1323 -1382 -2198 -175 1177 -580 -395 149 -2799 -1250 -872 1497 723 1662 -1832 468 -1829 879 1354 -730 276 -1188 2951 -158 -409 -465 983 1221 220 2153 1383 -518 -919 -1601 -218 27 -99 2292 -1376 -481 1345 627 666 -1311 243 -613 -973 469 -489 414 569 -1387 -537 138 -125 683 -1351 896 576 1269 1870 2239 -531 -471 569 38 -1712 2493 916 1680 3870 -194 9 -1134 -96 -959 469 -1644 -80 -2456 -1029 -1979 -2170 662 1148 731 -911 345 -805 1630 -2518 -1055 -1805 256 -90 1186 -7 1311 -1347 10 -930 -1745 -2518 -227 -4359 519 -435 4903 1290 1497 2054 -1116 -1347 -376 -1609 734 -1473 814 482 659 4141 1940 -1642 462 1085 -808 -182 387 -2161 -739 2820 -336 9 -1035 2016 2027 -1560 -1880 -1121 -316 SS 20250119T142650.2Z 9150.601970 318 1 1.76 2 66.75 122.75 65.19 257.51 0.00 1 0.00 1 0 17 9.497e-03 5.922e-03 5.294e-03 2.006e-03 2.760482e-01 1.069573e-03 3.006834e-03 -6.000000e+00 5.737477e-03 224.55 -2.00 3.11 -2.00 316.82 0.00e+00 8.358615e-04 1.415005e-04 1.055609e-04 -6.000000e+00 2.618755e-04 290.46 -2.00 20.00 -2.00 316.01 0.00e+00 2.513 0.000 302.00 328.00 3 2.0328e+00 2.7736e-03 2.7185e-02 -6.0000e+00 1.4099e-02 5.4830e-04 3.0991e-03 1.2608e-02 -6.0000e+00 1.5207e-02 6.4344e-03 1.8299e-03 6.2072e-03 -6.0000e+00 9.1293e-03 -6.2444e-03 8.9181e-04 1.8460e-03 -6.0000e+00 3.9753e-03 4.4556e-03 -2.2333e-04 6.3775e-05 2.4096e-05 -6.0000e+00 2.9315e-04 -4.7838e-02 -3.4572e-05 12 1 1 12 1 1 74.12 19.91 0.18 -0.04784 -0.04952 16 585 1 5 0 102.620 26.11 20.00 19.91 32.68 36.2 984.73 1670 -504 79 -4245 -2910 -2642 -1328 -622 1334 -567 -1236 -1872 -1041 -869 -1282 467 -269 -678 800 -312 1310 -725 901 1001 1144 490 122 1070 815 921 1078 1961 679 -1290 -2427 -1806 -1243 202 247 -834 -1400 -790 -822 -934 -853 -359 -703 -25 -398 115 610 687 966 948 805 546 570 92 92 361 1400 1618 1778 1127 597 18 -186 478 962 594 147 230 209 156 252 -173 -391 -420 -427 -707 -1277 -2113 -1436 -1510 -1467 -703 -205 65 -162 384 286 290 -33 697 609 587 521 165 -343 -206 -586 -594 -195 189 -774 -797 -930 89 216 731 309 279 -39 -8 364 594 833 520 216 -310 -19 -261 -9 -173 313 269 277 900 290 342 -305 -242 -43 45 -137 25 80 79 -117 -142 -382 -312 213 -72 11 -610 -379 -329 -171 -89 206 -94 -209 -332 -205 -182 -308 121 -75 -184 222 -91 382 -217 271 316 381 170 42 350 254 285 351 689 260 -514 -948 -697 -483 90 123 -454 -841 -471 -505 -581 -532 -222 -431 -16 -251 73 383 461 688 672 591 412 436 71 70 273 1085 1274 1509 967 515 15 -151 380 812 532 137 223 203 146 230 -151 -315 -343 -347 -611 -1187 -2181 -1510 -1614 -1670 -814 -249 78 -194 459 333 323 -35 738 650 661 625 209 -443 -263 -737 -722 -227 226 -954 -1043 -1232 122 302 1046 464 425 -58 -11 501 805 1123 705 301 -458 -27 -390 -13 -251 431 367 366 1190 394 496 -451 -370 -65 71 -220 41 135 135 -201 -239 -643 -507 SS 20250119T143257.0Z 9150.606215 322 1 25.77 2 65.53 123.59 66.58 258.10 0.00 1 0.00 1 0 17 2.194e-02 8.622e-03 1.956e-02 5.632e-03 2.632460e-01 2.986684e-03 2.898610e-03 -6.000000e+00 1.324729e-02 224.55 -2.00 3.11 -2.00 317.49 0.00e+00 1.515115e-03 4.693754e-04 2.145823e-04 -6.000000e+00 6.048421e-04 290.46 -2.00 20.00 -2.00 316.66 0.00e+00 2.398 0.000 302.00 328.00 3 6.2104e+00 7.8354e-03 2.5982e-02 -6.0000e+00 3.2552e-02 8.4194e-02 8.8209e-03 1.2143e-02 -6.0000e+00 3.5117e-02 5.1420e-03 5.3657e-03 6.0222e-03 -6.0000e+00 2.1081e-02 -7.9700e-03 2.6969e-03 1.9361e-03 -6.0000e+00 9.1761e-03 7.4438e-05 -7.4349e-04 1.8163e-04 2.3922e-05 -6.0000e+00 6.7729e-04 -4.6898e-02 -1.1144e-04 12 9 1 12 1 1 99.97 19.91 0.27 -0.04690 -0.05249 6 16 1 5 0 3680.540 26.11 19.98 19.91 33.09 36.5 984.79 6114 -1860 2541 -7407 -4626 -2296 -2478 4627 -6064 -3585 -13225 1577 -7216 -1786 2571 805 1834 1492 -2289 2464 413 2582 1968 -1016 -463 2374 -102 2589 4542 1526 3920 230 751 -2613 1758 -2211 -1714 -552 -540 439 -976 -28 547 -1220 -1968 449 77 -2607 -1258 297 -602 -18 1415 -1007 1373 -297 -701 809 -1101 591 158 3727 893 3046 -584 676 -880 -92 821 481 2019 1206 1376 862 240 -378 -1586 -2105 -2650 -1523 -1575 -1854 -1399 -1465 -1158 -515 192 560 803 1141 472 -403 -341 -652 306 704 341 504 351 -139 -1056 -641 -795 -1333 -642 -1364 -146 -150 800 1362 1261 447 523 420 -407 491 -167 1 -488 256 -223 -140 -665 -10 212 -61 453 165 995 117 -357 -505 5 -274 17 134 234 -114 468 -132 -13 -638 548 -196 263 -803 -450 -210 -237 456 -723 -436 -1784 193 -1064 -286 448 156 372 316 -521 554 97 595 463 -257 -122 626 -27 650 1075 368 971 64 221 -806 506 -657 -544 -199 -226 206 -503 -15 299 -686 -1117 249 42 -1444 -683 161 -342 -11 880 -665 913 -204 -489 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