File name: Pandora141s1_Calakmul_20241120_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20241121T055156.8Z 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_20241120_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: 20241120 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 20241120T130215.6Z 9090.543236 282 1 59.70 2 78.92 115.55 41.22 286.68 0.00 1 0.00 1 0 17 4.203e-01 7.224e-03 2.465e-01 5.270e-03 5.249590e-01 2.962238e-03 5.580177e-03 -6.000000e+00 2.556442e-01 225.81 -2.00 3.11 -2.00 320.62 0.00e+00 2.555012e-03 1.236052e-03 1.068366e-03 -6.000000e+00 1.171543e-02 291.95 -2.00 20.00 -2.00 319.92 0.00e+00 5.017 0.001 302.00 328.00 3 3.8750e+00 9.4725e-03 5.4005e-02 -6.0000e+00 6.2965e-01 3.2440e-02 1.2247e-02 2.5168e-02 -6.0000e+00 6.7823e-01 -1.2099e-02 1.0866e-02 1.3408e-02 -6.0000e+00 4.0703e-01 -2.0548e-03 5.4192e-03 4.5242e-03 -6.0000e+00 1.7844e-01 5.0026e-05 -1.4330e-03 1.7004e-04 6.2559e-05 -6.0000e+00 1.3054e-02 -6.1525e-02 -3.3625e-05 11 9 0 11 8 0 99.98 19.95 0.34 -0.06153 -0.07229 41 41 1 5 0 1455.750 26.00 20.00 19.95 33.78 34.0 982.57 900000 -89147 10723 -60142 -59628 -1098 13224 125881 -591 318016 -105561 288603 -24110 -5197 25803 -48441 23486 36320 1449 -12727 6509 6030 -2446 -24228 -20508 1356 -23943 27871 -7350 -28464 -8171 -15297 1255 -394 8784 -5650 -1859 -13801 2763 -9715 -5813 2044 2841 2995 4040 4531 3806 881 3601 3878 -941 684 3362 1731 2395 -1476 1097 1360 2368 -729 -77 3629 3654 2395 -1023 1017 -1071 2048 1631 -1737 2506 -580 1160 -517 635 1904 -444 -466 -1933 -1460 -1293 517 -2558 -578 -1927 -438 -408 477 234 322 811 1159 -251 -829 842 -422 41 494 -247 -348 -1010 -708 666 -654 -329 -1218 -664 -750 664 333 831 250 420 -227 307 280 543 566 490 277 -517 -179 -15 272 -389 -530 354 271 466 456 -197 -418 -542 -269 -183 -167 252 215 177 28 -153 -6 900000 -1112 56 -615 -577 -6 68 647 -4 1634 -2391 1483 -335 -75 338 -1498 416 624 37 -396 176 167 -76 -990 -872 50 -1132 802 -293 -1448 -386 -895 71 -24 494 -365 -125 -1216 250 -1160 -752 266 386 420 572 650 560 136 561 636 -175 138 722 406 590 -393 293 364 622 -197 -21 1050 1174 851 -392 379 -398 752 650 -798 1211 -303 598 -261 296 807 -180 -188 -851 -730 -737 325 -1799 -425 -1523 -362 -354 424 209 280 667 896 -188 -630 679 -385 42 557 -300 -427 -1195 -777 685 -682 -359 -1414 -807 -963 903 492 1308 411 689 -364 468 412 798 859 779 457 -869 -295 -24 423 -590 -780 507 398 733 780 -363 -807 -1088 -565 -403 -381 588 509 421 66 -345 -13 SS 20241120T130829.8Z 9090.547567 285 1 60.31 2 77.59 116.18 42.60 286.67 0.00 1 0.00 1 0 17 1.772e-01 6.682e-03 1.118e-01 3.194e-03 4.782706e-01 1.758736e-03 5.078727e-03 -6.000000e+00 1.078340e-01 225.81 -2.00 3.11 -2.00 320.17 0.00e+00 8.679856e-04 6.302849e-04 9.579076e-04 -6.000000e+00 4.917834e-03 291.95 -2.00 20.00 -2.00 319.42 0.00e+00 4.520 0.000 302.00 328.00 3 3.6409e+00 5.3088e-03 4.8784e-02 -6.0000e+00 2.6562e-01 2.0055e-02 6.5793e-03 2.2974e-02 -6.0000e+00 2.8594e-01 -1.0527e-02 5.4764e-03 1.1410e-02 -6.0000e+00 1.7168e-01 -5.6468e-04 2.8098e-03 3.2635e-03 -6.0000e+00 7.4890e-02 1.0605e-04 -8.7960e-04 1.0293e-04 4.4933e-05 -6.0000e+00 5.4694e-03 -6.2459e-02 1.0720e-04 11 9 0 11 8 0 99.99 19.96 0.18 -0.06246 -0.06907 68 68 1 5 0 886.800 26.11 19.99 19.96 34.02 33.9 982.70 -69153 22858 -55365 124786 -94811 19438 -47885 -18826 -24445 -29176 -2235 -49165 -4990 -29267 2143 -11381 9577 -7507 -15835 -744 2874 10784 -11482 10561 -2384 -112 -1562 -10172 5022 -12549 -185 -1953 14388 -5511 5486 -645 -5931 3094 -4536 3685 -5377 2619 -818 2187 115 1045 2666 -2304 218 -2578 3054 -1545 1746 923 -80 2817 -367 519 -1683 3212 50 1387 1209 1343 1284 698 2020 135 2826 568 2322 -249 1271 127 -822 945 -1513 323 -1125 -387 -1728 -1580 -1855 -2202 -374 -1089 382 -64 914 -188 -128 83 -290 -58 -199 830 194 1445 -111 -73 -585 -777 -324 -498 -402 -1032 -315 -355 74 557 410 -2 -444 53 -51 821 223 782 195 -145 110 -331 384 169 666 -224 513 495 -68 169 -410 -116 -794 219 -329 -291 362 145 184 -55 180 -418 -1116 181 -968 401 -2244 156 -758 -256 -394 -532 -34 -1239 -97 -863 56 -393 302 -300 -731 -31 122 434 -588 473 -130 -6 -91 -629 265 -802 -12 -142 1004 -491 440 -55 -570 319 -601 530 -944 460 -156 415 23 206 523 -480 45 -577 698 -403 479 273 -25 899 -124 175 -573 1040 17 505 486 584 579 312 866 60 1303 297 1304 -150 760 74 -455 474 -724 150 -564 -217 -1111 -1128 -1437 -1815 -321 -995 362 -62 889 -181 -117 71 -238 -48 -175 800 209 1693 -140 -92 -718 -893 -353 -546 -461 -1256 -399 -474 104 840 656 -4 -736 85 -78 1208 328 1183 309 -239 184 -547 618 265 1009 -331 738 724 -106 285 -736 -215 -1539 438 -691 -634 805 328 417 -123 389 -876 SS 20241120T131829.8Z 9090.554512 291 1 17.83 2 75.47 117.24 44.82 286.71 0.00 1 0.00 1 0 17 1.076e-01 8.701e-03 1.162e-01 6.648e-03 4.251977e-01 3.596791e-03 4.624349e-03 -6.000000e+00 6.543595e-02 225.80 -2.00 3.11 -2.00 319.40 0.00e+00 6.499751e-04 1.006443e-03 1.165908e-03 -6.000000e+00 2.984646e-03 291.95 -2.00 20.00 -2.00 318.60 0.00e+00 3.903 0.000 302.00 328.00 3 4.6305e+00 1.0158e-02 4.2523e-02 -6.0000e+00 1.6118e-01 4.9553e-02 1.2022e-02 2.0882e-02 -6.0000e+00 1.7352e-01 -6.2507e-03 9.1008e-03 9.9697e-03 -6.0000e+00 1.0418e-01 -3.2023e-03 4.8002e-03 2.7990e-03 -6.0000e+00 4.5443e-02 7.2340e-05 -7.0140e-04 2.1283e-04 3.6148e-05 -6.0000e+00 3.3195e-03 -6.3744e-02 2.6207e-05 12 9 1 12 1 1 98.04 19.95 0.17 -0.06374 -0.06901 6 24 1 5 0 2545.280 26.11 20.00 19.95 34.38 33.8 982.77 66208 -46024 59211 -19206 17956 -18361 24829 2460 22360 16967 -24832 17643 -291 -15194 -21668 -11640 -9786 -2229 7138 -3834 11044 -13121 6802 955 -2673 -121 7229 -6205 -16829 5106 -7816 9508 3468 5302 5903 -831 -3024 -5909 656 -3142 1885 -4605 -2010 2585 43 3751 -2784 -898 -4073 74 -341 -2397 1098 -816 3139 -315 906 1050 973 1730 3239 2864 1174 4032 670 275 -2718 339 1272 4264 1115 2046 674 -646 656 -843 1389 -2332 -361 -2443 -2118 -1665 -2287 -1018 -422 -415 -437 232 -307 566 275 326 -394 -863 -625 409 1474 238 -18 -100 0 -1001 -984 -462 -1638 -828 -581 -445 661 230 960 -118 740 -326 199 -15 287 -76 923 674 -100 767 -66 -140 -439 370 293 578 466 -434 608 -215 -555 77 156 -883 -403 342 26 224 -92 -153 630 -1413 723 -478 298 -414 395 54 457 392 -886 455 -10 -729 -1303 -727 -659 -150 467 -292 756 -1145 508 80 -249 -12 653 -621 -1817 456 -854 994 424 670 735 -110 -439 -1023 127 -732 466 -1293 -575 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