File name: Pandora141s1_Calakmul_20240810_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20260427T091056.4Z 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_20240810_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: 20240810 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 20240810T123845.1Z 8988.526911 63 1 59.43 2 76.92 78.00 144.00 83.59 0.00 1 0.00 1 0 17 4.653e-01 2.828e-02 3.341e-01 2.191e-02 5.137154e-01 1.235038e-02 6.333812e-03 -6.000000e+00 2.870008e-01 227.31 -2.00 3.11 -2.00 320.61 0.00e+00 4.721774e-03 4.831377e-03 5.074414e-03 -6.000000e+00 1.428506e-02 293.76 -2.00 20.00 -2.00 319.82 0.00e+00 4.304 0.000 302.00 328.00 3 6.2363e+00 3.9267e-02 5.3160e-02 -6.0000e+00 7.0990e-01 2.4422e-01 4.8960e-02 3.9522e-02 -6.0000e+00 7.6769e-01 -2.6440e-01 3.7930e-02 1.5975e-02 -6.0000e+00 4.5578e-01 9.5879e-02 1.8982e-02 3.3772e-03 -6.0000e+00 1.9633e-01 8.7025e-06 -1.2464e-03 7.3040e-04 8.2169e-05 -6.0000e+00 1.4785e-02 -3.0447e-03 -1.3928e-04 12 9 8 11 8 0 99.98 21.03 0.88 -0.00304 -0.01241 15 15 1 5 0 3958.980 26.94 20.00 21.03 32.30 21.1 984.51 900000 12137 59984 -49075 -142160 900000 -47059 900000 -113543 900000 76300 -134093 36169 115297 209900 -52427 228256 37775 -7821 -30512 28664 12327 35434 222463 -11669 900000 32800 -12964 -11947 2211 42530 45572 85515 7790 19921 -36396 25729 146588 16284 22065 -7773 35711 -48 66215 5967 33295 -8700 32107 35607 10190 9863 2087 15410 -12023 5687 16257 5353 -9395 1576 1769 -5728 5358 226 10303 -1455 -2374 6942 -12347 4981 6051 1549 -3299 3613 2420 4119 -2475 -6821 -5475 -3878 277 -4307 879 -1100 -1669 -5864 4536 -1562 -3035 2773 -1738 7656 -5128 -2828 3685 1010 267 238 430 -1727 606 -5075 971 -5706 -2505 9 -972 3265 -813 2588 -1918 2521 -800 3496 -1459 133 666 1111 878 406 3092 -1237 -224 2277 180 318 -89 -1867 -39 929 -335 -163 -1248 -996 -1439 -344 435 598 978 971 -107 255 -1733 900000 259 1280 -1156 -7465 900000 -1049 900000 -5569 900000 1629 -9735 772 2461 4480 -3447 4872 1240 -413 -2054 1118 561 1333 4748 -751 900000 1401 -829 -760 132 1967 2327 3273 628 1399 -4413 1922 4130 1828 2659 -1351 4345 -8 6371 1023 4460 -1749 4464 4941 1899 1998 494 3456 -3691 1532 4066 1496 -2987 445 501 -1836 1689 83 3653 -584 -933 2450 -5431 2045 2731 780 -1783 1791 1146 1764 -1034 -2829 -2304 -1782 141 -2589 556 -763 -1234 -4794 3556 -1352 -2712 2315 -1452 5489 -3906 -2044 2606 808 243 244 485 -2083 702 -5800 969 -5867 -2572 10 -1103 3761 -1039 3472 -2919 3909 -1307 5389 -2250 192 935 1582 1310 640 4888 -2033 -355 3424 266 455 -123 -2609 -56 1454 -578 -299 -2421 -2016 -3083 -770 1003 1408 2316 2279 -244 558 -3718 SS 20240810T124534.6Z 8988.531650 66 1 59.36 2 75.34 78.46 142.46 84.38 0.00 1 0.00 1 0 25 2.449e-01 7.575e-03 1.214e-01 4.540e-03 4.474687e-01 2.474073e-03 4.764821e-03 -6.000000e+00 1.485982e-01 227.31 -2.00 3.11 -2.00 320.09 0.00e+00 2.581196e-03 8.576828e-04 9.840232e-04 -6.000000e+00 6.840482e-03 293.76 -2.00 20.00 -2.00 319.27 0.00e+00 3.869 0.000 302.00 328.00 3 4.7380e+00 7.4731e-03 4.2601e-02 -6.0000e+00 3.6697e-01 -6.6382e-04 9.1727e-03 2.1242e-02 -6.0000e+00 3.9573e-01 5.1280e-03 7.3093e-03 1.0976e-02 -6.0000e+00 2.3753e-01 -9.3761e-03 3.7521e-03 3.5580e-03 -6.0000e+00 1.0242e-01 6.7240e-05 -9.1277e-04 1.4881e-04 4.9663e-05 -6.0000e+00 7.5822e-03 -5.0177e-03 -1.5646e-04 11 9 0 11 8 0 99.98 21.03 0.16 -0.00502 -0.01188 44 44 1 5 0 1348.880 26.94 20.00 21.03 32.47 21.0 984.53 -32483 -7047 646 -14617 258928 -76821 -4457 -44396 -6091 5397 -11335 4586 -34681 14808 -5459 -11617 -7790 29910 -23847 18162 5876 -1727 4134 -8958 8320 -4292 447 -11125 3582 9900 6828 8950 -9630 2725 -11753 -294 -4522 -433 -3655 -1190 2641 -6700 -982 -2644 1604 179 2222 817 -1374 2209 66 3869 -1114 3787 887 2386 -920 -68 1751 -502 1506 998 2355 -618 -122 2019 2038 1611 208 879 311 1762 88 853 -385 -801 873 -208 820 -1742 -515 -3561 -716 -2556 -1155 -390 -113 331 -81 1616 258 958 472 1625 566 651 910 -442 -100 -572 -622 -1205 -737 -516 -1493 -630 -952 32 304 828 -294 243 -27 -428 934 216 1128 437 359 46 366 -324 -1 -117 -396 592 491 499 -92 524 -266 -466 -179 52 -31 -475 59 -87 263 98 -356 126 -513 -98 9 -215 1146 -1905 -62 -996 -106 89 -230 90 -1159 378 -197 -501 -354 1032 -1432 773 287 -92 218 -572 481 -288 29 -777 218 603 481 699 -977 252 -1225 -28 -507 -55 -570 -208 487 -1429 -206 -577 341 39 480 181 -320 525 17 1066 -346 1190 298 817 -330 -24 604 -179 555 402 1029 -294 -58 914 903 740 106 494 188 1082 54 496 -210 -404 412 -101 432 -1068 -351 -2733 -573 -2199 -1041 -369 -111 330 -80 1519 231 803 384 1348 515 659 1020 -544 -127 -720 -739 -1347 -800 -577 -1776 -782 -1242 44 442 1284 -483 401 -44 -666 1375 312 1642 666 573 76 603 -527 -2 -180 -589 846 696 735 -146 889 -477 -867 -345 104 -65 -1035 131 -194 584 212 -750 257 SS 20240810T125706.4Z 8988.539658 69 1 60.69 2 72.66 79.23 139.86 85.62 0.00 1 0.00 1 0 17 4.770e-02 5.833e-03 3.976e-02 3.270e-03 3.920021e-01 1.757657e-03 4.174453e-03 -6.000000e+00 2.897582e-02 227.31 -2.00 3.11 -2.00 319.40 0.00e+00 6.121572e-04 4.863986e-04 8.695014e-04 -6.000000e+00 1.332136e-03 293.76 -2.00 20.00 -2.00 318.53 0.00e+00 3.305 0.000 302.00 328.00 3 4.9625e+00 5.0011e-03 3.6657e-02 -6.0000e+00 7.1559e-02 -8.3776e-04 5.9085e-03 1.8777e-02 -6.0000e+00 7.7141e-02 1.2108e-02 4.3112e-03 9.0641e-03 -6.0000e+00 4.6305e-02 -1.2878e-02 2.2560e-03 2.4952e-03 -6.0000e+00 1.9985e-02 9.6919e-05 -4.1660e-05 1.0704e-04 3.2723e-05 -6.0000e+00 1.4762e-03 -6.5133e-03 6.2786e-05 10 0 0 10 0 0 99.83 21.03 0.21 -0.00651 -0.00683 32 32 1 5 0 1896.300 26.94 20.00 21.03 32.58 21.0 984.76 -27463 11035 -23516 -10980 -14631 17633 -6673 -522 13896 -10879 -10853 -2789 -9394 6156 -5576 -1240 1042 -4570 -4888 -5177 -1396 1517 3513 762 -4338 -3456 -446 -4077 8449 -5263 2535 1540 -2998 386 -1253 -2862 -2596 -2414 195 -988 -1111 -1455 -797 -880 -1404 1546 -1390 -515 1152 783 378 -287 781 -34 1642 767 880 -108 1438 1668 1229 2418 2949 1943 -419 -40 -442 859 1746 1490 1016 685 356 -426 -625 36 -1610 -1337 -546 -751 -1685 -2005 -1676 -1152 -1293 71 512 512 544 495 -328 -336 -895 -121 45 503 717 -100 13 -685 -602 -553 -78 -161 -825 -793 -274 -418 688 482 604 238 497 274 -6 501 51 45 75 -41 204 331 -78 -3 186 -170 219 228 345 224 -721 -218 -321 -243 -114 -126 151 375 369 -37 -219 -352 -772 238 -716 -285 -370 330 -170 -14 364 -379 -395 -103 -431 288 -338 -80 71 -351 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