File name: Pandora141s1_Calakmul_20240802_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20260427T091026.2Z 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 v1.8.88 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20240802_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: 20240802 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 20240802T130136.6Z 8980.542784 125 1 25.56 2 71.27 77.19 49.87 69.77 0.00 1 0.00 1 0 17 5.357e-02 7.789e-03 4.260e-02 4.484e-03 3.813701e-01 2.403968e-03 4.101354e-03 -6.000000e+00 3.258796e-02 227.38 -2.00 3.11 -2.00 318.98 0.00e+00 2.458950e-04 5.850770e-04 8.153584e-04 -6.000000e+00 1.495925e-03 293.75 -2.00 20.00 -2.00 318.09 0.00e+00 3.075 0.000 302.00 328.00 3 5.0916e+00 6.6665e-03 3.4533e-02 -6.0000e+00 8.0497e-02 1.0661e-02 7.7499e-03 1.8307e-02 -6.0000e+00 8.6736e-02 -2.6989e-03 5.4134e-03 8.7207e-03 -6.0000e+00 5.2063e-02 -3.1918e-03 2.8465e-03 2.4618e-03 -6.0000e+00 2.2503e-02 1.0599e-04 -4.5956e-04 1.4445e-04 3.0521e-05 -6.0000e+00 1.6575e-03 -1.8784e-02 -6.3687e-05 12 9 1 12 9 1 99.96 20.75 0.14 -0.01878 -0.02224 11 28 1 5 0 2129.600 26.73 20.00 20.75 32.91 20.1 985.06 -8997 -7435 -12147 -11391 11028 -1601 22035 -15054 25044 -20283 21545 -14686 -12769 7098 -3444 5711 -9204 -220 -7008 612 -2912 7645 8550 2633 4496 -4414 6543 -4439 5814 -6586 482 3316 3778 433 -5444 -829 -2396 1957 -3592 1071 -1170 -3179 547 -2141 1942 -1126 1236 -2325 1851 -595 104 1627 -665 1048 -589 125 -28 1075 -657 289 991 1631 2850 859 517 197 -941 -277 1465 2970 1132 1482 -890 1006 -801 714 233 397 -358 -2433 -1561 -2422 -1567 -1429 -1333 -156 323 212 -83 1116 -412 620 339 -59 -45 1109 1023 -277 24 -895 -388 -689 -415 -654 -978 -767 -1529 261 491 1030 766 458 -400 -154 121 1457 851 299 229 281 11 -100 -275 77 -138 -77 317 793 14 28 -829 -296 -230 -310 -166 -201 348 166 -118 -120 57 128 -290 -259 -454 -405 298 -48 577 -628 792 -1032 771 -800 -789 428 -264 447 -892 -21 -742 63 -316 765 881 307 548 -604 803 -583 679 -886 66 493 604 73 -948 -141 -456 421 -956 311 -378 -1101 189 -768 676 -404 434 -841 654 -223 41 684 -304 496 -293 63 -14 548 -337 148 523 917 1712 551 333 123 -571 -170 956 2095 863 1159 -705 755 -572 466 144 245 -237 -1823 -1281 -2166 -1475 -1409 -1383 -168 360 241 -94 1212 -429 605 318 -56 -46 1211 1217 -356 32 -1182 -487 -820 -482 -780 -1226 -1001 -2084 365 723 1590 1228 742 -640 -236 176 2058 1217 444 353 447 18 -159 -428 116 -202 -109 443 1132 21 45 -1386 -507 -403 -564 -313 -390 686 331 -235 -234 108 238 SS 20240802T130855.0Z 8980.547859 129 1 61.76 2 69.58 77.64 48.29 69.84 0.00 1 0.00 1 0 17 5.873e-02 8.030e-03 5.819e-02 6.201e-03 3.531429e-01 3.334364e-03 3.742920e-03 -6.000000e+00 3.574589e-02 227.38 -2.00 3.11 -2.00 319.17 0.00e+00 -7.093944e-04 8.439965e-04 2.461926e-04 -6.000000e+00 1.639860e-03 293.75 -2.00 20.00 -2.00 318.27 0.00e+00 2.836 0.000 302.00 328.00 3 6.3300e+00 9.3445e-03 3.1776e-02 -6.0000e+00 8.8302e-02 1.9000e-03 1.0929e-02 1.6511e-02 -6.0000e+00 9.5117e-02 1.9387e-02 7.6690e-03 8.0342e-03 -6.0000e+00 5.7096e-02 -1.1640e-02 4.0077e-03 2.3863e-03 -6.0000e+00 2.4701e-02 3.9802e-05 -2.4950e-04 2.0523e-04 2.9590e-05 -6.0000e+00 1.8162e-03 -2.1696e-02 4.4500e-05 11 9 0 11 8 0 99.68 20.75 0.81 -0.02170 -0.02357 17 17 1 5 0 3632.090 26.73 20.00 20.75 33.16 20.2 985.11 -32410 -9305 5875 -31719 20668 -2640 -9539 -1461 21108 -6748 -5671 -1177 1494 7588 8103 -7875 4001 11172 23025 1192 8087 -9717 -1673 -1611 2301 -1645 -8740 7022 7617 2863 1388 3456 -3815 -3252 -3381 -1553 541 -2904 -1664 -1042 -485 -2732 145 -2182 2243 953 -2492 -2289 270 461 1596 -760 2595 -243 135 4276 -2078 -1318 -1197 1406 1471 1636 837 284 322 -472 677 1206 2984 3052 -150 -573 1102 -347 1207 -2188 -640 853 -993 663 -1987 -1174 -1819 -1628 -1572 -175 -76 1005 788 567 950 346 341 404 -8 564 352 -368 17 -1037 -975 -547 404 -333 554 -881 -1088 -594 40 286 793 -428 343 9 515 637 1234 50 59 -255 -571 -486 -99 846 128 -398 1159 725 399 -411 -371 -449 -128 521 -487 195 421 -342 413 -403 -193 -76 -1309 -331 185 -1367 507 -80 -334 -54 693 -305 -263 -56 79 444 541 -678 330 910 1759 117 761 -1101 -183 -188 277 -213 -1203 800 837 334 177 479 -611 -530 -539 -247 93 -609 -409 -292 -148 -899 48 -747 740 318 -854 -779 91 160 583 -306 1080 -109 63 1979 -1037 -651 -585 672 731 872 487 175 198 -280 381 683 1799 2034 -111 -438 825 -253 808 -1388 -374 486 -615 453 -1548 -993 -1650 -1557 -1594 -185 -84 1124 877 611 959 328 307 366 -8 597 411 -468 23 -1363 -1213 -636 454 -387 675 -1144 -1477 -841 60 451 1297 -713 554 14 748 894 1736 74 91 -412 -934 -782 -154 1274 187 -563 1584 1018 596 -659 -623 -776 -227 958 -944 389 857 -711 851 -818 -379 -145 SS 20240802T135017.7Z 8980.576594 155 1 60.04 2 59.96 80.06 39.32 69.61 0.00 1 0.00 1 0 17 8.690e-03 5.975e-03 3.123e-03 1.168e-03 2.485281e-01 6.258441e-04 2.692237e-03 -6.000000e+00 5.286606e-03 227.38 -2.00 3.11 -2.00 316.89 0.00e+00 1.343744e-04 8.424551e-05 1.362078e-04 -6.000000e+00 2.426371e-04 293.75 -2.00 20.00 -2.00 315.99 0.00e+00 1.989 0.000 302.00 328.00 3 4.7724e+00 1.6363e-03 2.2266e-02 -6.0000e+00 1.3059e-02 2.1190e-02 1.8306e-03 1.1445e-02 -6.0000e+00 1.4070e-02 6.9664e-03 1.0765e-03 5.5909e-03 -6.0000e+00 8.4457e-03 -7.5252e-03 5.2105e-04 1.5642e-03 -6.0000e+00 3.6510e-03 4.8740e-04 -7.3031e-05 3.7547e-05 2.1250e-05 -6.0000e+00 2.6883e-04 -1.9247e-02 -3.7544e-05 11 1 0 11 8 0 99.95 20.75 0.17 -0.01925 -0.01980 53 53 1 5 0 1132.720 26.73 20.00 20.75 36.43 20.1 985.49 -1829 -1405 -1967 -1891 -3590 -744 -152 1091 -1202 -950 -1797 -753 -377 -118 -438 -277 297 -35 583 352 -95 890 885 1227 814 309 -62 -97 462 1284 1878 2090 533 -1250 -1346 -1303 -890 271 -394 -1128 -1381 -815 -922 -484 -650 -587 -929 -761 -427 375 658 651 745 275 952 866 402 239 346 956 1315 1628 1486 742 -83 86 149 846 1320 741 340 243 366 -16 -94 -2 -259 131 -390 -710 -1377 -1998 -1822 -1622 -966 -536 -432 -268 -48 252 387 549 514 1014 682 730 417 -43 -337 -595 -851 -446 472 -158 -743 -759 -720 -216 412 492 155 19 -32 43 388 714 817 672 94 -164 -259 -83 -119 1 223 487 739 793 496 45 -446 -123 143 273 -86 -165 127 -115 -259 -298 -196 -248 -249 -204 -287 -258 -456 -90 -19 154 -189 -155 -298 -129 -72 -24 -101 -69 77 -10 162 101 -28 259 265 385 270 105 -21 -31 139 380 582 697 191 -458 -476 -465 -348 117 -202 -628 -836 -513 -594 -312 -420 -376 -585 -467 -258 228 421 422 510 197 699 650 306 181 259 715 1020 1288 1262 660 -73 71 121 677 1081 676 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