File name: Pandora141s1_Calakmul_20240816_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20260427T091148.6Z 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_20240816_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: 20240816 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 20240816T134329.9Z 8994.571874 178 1 25.82 2 61.98 84.31 159.06 239.64 0.00 1 0.00 1 0 17 9.423e-03 5.662e-03 3.019e-03 1.142e-03 2.670764e-01 6.120147e-04 2.879932e-03 -6.000000e+00 5.722739e-03 227.27 -2.00 3.11 -2.00 316.87 0.00e+00 3.917017e-04 8.265923e-05 2.024558e-04 -6.000000e+00 2.632016e-04 293.76 -2.00 20.00 -2.00 315.98 0.00e+00 2.118 0.000 302.00 328.00 3 3.8614e+00 1.5968e-03 2.3734e-02 -6.0000e+00 1.4132e-02 1.4384e-02 1.7881e-03 1.2228e-02 -6.0000e+00 1.5235e-02 9.8497e-03 1.0495e-03 5.9699e-03 -6.0000e+00 9.1454e-03 -8.2198e-03 5.0658e-04 1.6664e-03 -6.0000e+00 3.9468e-03 1.0427e-03 -4.8574e-05 3.6407e-05 2.2478e-05 -6.0000e+00 2.9166e-04 -6.4957e-03 1.5278e-05 12 1 1 12 1 1 99.92 21.01 0.20 -0.00650 -0.00686 52 123 1 5 0 486.990 26.94 20.00 21.01 35.45 22.6 983.30 -536 -1632 -2350 -2476 -3230 -3105 -1557 989 -1174 -1101 -2007 -314 -212 -114 -13 -537 -435 609 482 777 1027 1062 454 467 1098 314 -249 -280 663 1225 2020 2181 522 -1719 -2075 -2861 -1585 -383 -404 -889 -1067 -594 -576 -667 -324 -258 -699 -674 -267 425 515 825 776 542 890 805 491 -5 573 715 1077 1872 1590 834 169 -278 -398 421 1055 813 457 250 483 147 6 -251 -734 -757 -916 -952 -1283 -1741 -1714 -1235 -854 -357 88 188 89 405 264 -54 205 270 237 546 403 124 -226 -443 -849 -688 -120 -225 -897 -663 -674 -190 561 707 445 326 127 123 225 530 642 552 155 -223 122 -64 118 243 168 144 505 453 216 105 -372 -300 -104 50 -102 -70 225 7 -54 -252 -279 -291 -72 -219 -345 -340 -412 -388 -206 143 -189 -183 -341 -56 -39 -24 -3 -138 -117 170 139 231 309 322 142 155 351 103 -80 -93 209 386 672 725 187 -630 -738 -1041 -632 -178 -206 -517 -628 -364 -360 -421 -204 -161 -430 -407 -159 257 330 562 560 383 647 598 369 -4 423 531 832 1545 1329 729 145 -239 -324 342 925 745 426 240 458 141 5 -215 -584 -593 -768 -840 -1266 -1777 -1863 -1340 -986 -415 106 231 109 494 299 -59 210 277 260 624 485 163 -291 -586 -1054 -838 -143 -279 -1136 -885 -897 -264 781 1041 680 497 186 176 298 706 863 743 222 -321 177 -91 171 338 234 191 649 597 304 149 -557 -439 -157 79 -162 -116 381 11 -92 -421 -450 -476 SS 20240816T135010.9Z 8994.576515 181 1 60.65 2 60.41 84.76 160.34 238.08 0.00 1 0.00 1 0 17 2.112e-02 8.592e-03 1.592e-02 4.300e-03 2.624186e-01 2.289392e-03 2.858463e-03 -6.000000e+00 1.282269e-02 227.27 -2.00 3.11 -2.00 317.68 0.00e+00 2.382683e-04 3.774491e-04 5.001301e-04 -6.000000e+00 5.898401e-04 293.76 -2.00 20.00 -2.00 316.76 0.00e+00 2.016 0.000 302.00 328.00 3 6.6149e+00 6.0756e-03 2.2849e-02 -6.0000e+00 3.1664e-02 7.2931e-02 6.8661e-03 1.2253e-02 -6.0000e+00 3.4138e-02 1.3926e-02 4.1665e-03 5.8783e-03 -6.0000e+00 2.0492e-02 -1.1859e-02 2.0866e-03 1.6809e-03 -6.0000e+00 8.8427e-03 7.1478e-05 -7.1810e-05 1.3993e-04 2.1763e-05 -6.0000e+00 6.5361e-04 -6.2175e-03 -3.2330e-06 11 8 0 10 0 0 99.96 21.01 0.53 -0.00622 -0.00676 25 25 1 5 0 2425.610 26.94 19.99 21.01 35.72 22.5 983.38 4942 -2126 -502 -11327 4039 -5168 5108 6228 -4619 6756 -1984 -4706 -1508 -117 2862 316 2053 -1116 1943 -1207 -256 24 -534 1058 2845 -1844 751 4121 3127 3936 -1498 5895 -2506 -1333 -1840 -1789 -2006 -3470 736 -70 -360 -1749 -2442 -698 118 -379 -1678 108 -2388 -508 -832 245 645 1465 2681 -102 -64 -637 259 -240 809 2070 2080 2039 786 472 -824 494 373 1312 377 1453 1098 524 557 -701 -1145 -1624 -1713 -1842 -1213 -1917 -2273 -1478 -1068 1277 368 1018 1011 387 383 -704 -439 -911 -259 147 900 230 67 -283 -1128 -1449 -442 -820 -1615 -631 -85 -71 752 1054 1331 487 315 -164 -554 -80 -28 192 278 744 107 690 -66 214 -396 -312 18 -595 263 -772 -410 -517 418 -141 -324 657 499 449 132 122 -937 -268 430 -211 -49 -1153 329 -453 436 587 -525 712 -231 -593 -207 -18 480 59 393 -229 401 -264 -56 5 -122 252 700 -484 188 954 702 880 -373 1481 -719 -379 -509 -503 -624 -1278 304 -33 -181 -928 -1333 -378 63 -203 -894 56 -1251 -267 -461 143 394 924 1717 -68 -43 -430 172 -161 560 1508 1616 1635 625 355 -596 356 289 1102 339 1329 998 460 456 -533 -814 -1144 -1280 -1519 -1092 -1869 -2346 -1590 -1210 1494 451 1260 1238 459 426 -734 -433 -902 -270 166 1094 300 90 -373 -1417 -1725 -514 -991 -2072 -840 -117 -102 1119 1637 2117 777 486 -240 -767 -107 -38 269 408 1130 165 1048 -98 307 -550 -416 24 -795 366 -1140 -624 -805 661 -233 -556 1157 898 818 239 217 -1642 -456 SS 20240816T135610.0Z 8994.580671 184 1 10.78 2 59.00 85.17 161.47 236.47 0.00 1 0.00 1 0 17 1.904e-02 8.249e-03 1.356e-02 5.219e-03 2.483109e-01 2.793295e-03 2.644619e-03 -6.000000e+00 1.157424e-02 227.27 -2.00 3.11 -2.00 316.78 0.00e+00 9.637594e-05 3.691670e-04 2.251722e-04 -6.000000e+00 5.315960e-04 293.76 -2.00 20.00 -2.00 315.90 0.00e+00 1.934 0.000 302.00 328.00 3 5.8077e+00 7.2847e-03 2.1733e-02 -6.0000e+00 2.8583e-02 4.1823e-02 8.1517e-03 1.1279e-02 -6.0000e+00 3.0804e-02 1.3219e-02 4.7801e-03 5.4948e-03 -6.0000e+00 1.8492e-02 -1.0129e-02 2.3041e-03 1.5402e-03 -6.0000e+00 7.9891e-03 1.8022e-04 9.8827e-04 1.6707e-04 2.0583e-05 -6.0000e+00 5.8898e-04 -8.7681e-03 2.2619e-04 12 9 1 12 1 1 99.95 21.01 0.36 -0.00877 -0.00134 3 22 1 5 0 2693.500 26.94 19.99 21.01 35.83 22.5 983.48 457 6830 1402 -7370 -7287 -7833 7885 2121 -1745 2446 -2947 -651 -4543 -3078 820 227 957 -2979 451 2333 1847 2622 2219 320 2008 -1781 -315 -255 1179 2074 923 2067 -1661 -2843 -3749 -1549 -2523 192 -186 -2188 -3 1148 -486 -45 894 -346 -1204 -19 -247 414 -1192 851 93 2177 810 694 633 -347 -264 247 974 2505 1901 453 -481 -152 -788 1556 138 702 186 231 1191 628 -837 -1754 -300 -241 -895 -1411 -518 -1656 -2270 -1351 -1425 -356 -234 666 75 1158 945 -1070 45 -159 73 728 313 514 598 421 -1102 -792 275 -194 -1675 -345 -1372 225 722 1063 1072 397 -154 66 -375 389 605 263 210 -193 508 363 -70 346 197 -622 67 546 193 -693 -698 -821 -151 -526 751 262 347 -254 137 110 -45 -425 62 934 202 -1082 -991 -1051 979 308 -285 397 -508 -115 -922 -695 198 59 258 -860 130 682 551 782 680 105 675 -630 -108 -84 368 641 302 716 -623 -1077 -1393 -572 -1022 87 -97 -1274 -2 717 -313 -29 573 -222 -767 -12 -153 258 -785 579 66 1578 606 528 486 -267 -202 189 765 2047 1643 405 -426 -128 -640 1247 118 643 179 228 1161 596 -760 -1497 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