File name: Pandora141s1_Calakmul_20250216_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250217T062032.1Z 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_20250216_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: 20250216 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 20250216T143617.8Z 9178.608539 326 1 0.80 2 61.33 115.86 88.08 262.06 0.00 1 0.00 1 0 17 9.555e-03 5.959e-03 4.548e-03 2.423e-03 2.312244e-01 1.302657e-03 2.536820e-03 -6.000000e+00 5.796908e-03 225.25 -2.00 3.11 -2.00 315.90 0.00e+00 1.035867e-04 1.391230e-04 1.001794e-04 -6.000000e+00 2.636514e-04 290.64 -2.00 20.00 -2.00 315.14 0.00e+00 2.074 0.000 302.00 328.00 3 2.0665e+00 3.3395e-03 2.2525e-02 -6.0000e+00 1.4267e-02 1.2728e-02 3.7069e-03 1.0549e-02 -6.0000e+00 1.5373e-02 4.1650e-03 2.1444e-03 5.1835e-03 -6.0000e+00 9.2252e-03 -4.6962e-03 1.0007e-03 1.4777e-03 -6.0000e+00 4.0197e-03 6.9688e-03 -3.4528e-04 7.6736e-05 2.1413e-05 -6.0000e+00 2.9483e-04 -5.8870e-02 2.2402e-05 12 1 1 12 1 1 89.87 19.90 0.23 -0.05887 -0.06146 8 678 1 5 0 88.350 26.00 20.02 19.90 31.41 38.8 982.64 -2497 330 -3795 -945 -3726 -1875 -1266 -748 1248 -23 128 -1815 1689 -194 1208 139 -1577 880 379 1979 -423 1542 1047 1743 488 644 97 -817 1119 204 2244 1789 1214 -405 -1378 -1019 -1831 -317 -380 -669 -1093 -1000 -1297 -415 -593 -548 -1074 -719 -285 283 24 405 883 537 110 1122 484 730 303 462 589 1499 1728 913 -4 174 354 -15 868 679 814 628 190 487 -345 -168 -844 -172 -675 -893 -1196 -1606 -1748 -1689 -602 -653 -249 -45 109 152 -123 415 -71 198 61 713 154 281 -127 -275 42 -570 -84 475 -689 -645 -902 -380 553 881 179 196 -83 182 17 313 532 496 418 -73 72 -115 -170 199 196 119 627 561 592 259 -211 -90 -507 -68 -70 7 78 -87 -59 -266 -204 -289 -535 74 -898 -211 -792 -377 -261 -167 297 -6 32 -475 461 -59 397 49 -587 331 146 774 -171 618 425 728 213 288 43 -356 464 84 929 781 556 -190 -639 -467 -884 -167 -224 -431 -749 -708 -938 -301 -430 -397 -772 -508 -199 197 17 301 676 423 89 913 399 601 249 379 491 1289 1551 847 -4 157 306 -12 761 632 795 631 192 483 -331 -153 -730 -144 -578 -811 -1158 -1644 -1864 -1858 -681 -768 -301 -55 134 184 -144 461 -76 207 66 798 183 349 -163 -353 53 -686 -98 563 -852 -825 -1186 -511 761 1246 260 287 -120 252 23 404 685 652 568 -102 103 -164 -240 275 264 156 803 720 780 353 -296 -128 -735 -101 -106 11 123 -139 -95 -424 -320 -446 SS 20250216T145004.3Z 9178.618105 336 1 60.53 2 58.41 117.81 91.25 263.09 0.00 1 0.00 1 0 17 1.308e-02 7.444e-03 9.490e-03 3.523e-03 2.179506e-01 1.874234e-03 2.380962e-03 -6.000000e+00 7.936611e-03 225.25 -2.00 3.11 -2.00 317.00 0.00e+00 1.017593e-03 2.573978e-04 2.155804e-04 -6.000000e+00 3.609338e-04 290.64 -2.00 20.00 -2.00 316.17 0.00e+00 1.902 0.000 302.00 328.00 3 6.4669e+00 4.8801e-03 2.0787e-02 -6.0000e+00 1.9534e-02 7.9494e-02 5.4625e-03 9.9429e-03 -6.0000e+00 2.1047e-02 9.1468e-03 3.2310e-03 4.9020e-03 -6.0000e+00 1.2630e-02 -1.0671e-02 1.5782e-03 1.4676e-03 -6.0000e+00 5.5036e-03 9.9488e-05 -1.7050e-04 1.1402e-04 1.8672e-05 -6.0000e+00 4.0362e-04 -5.7708e-02 8.6830e-05 11 9 0 11 8 0 99.99 19.89 0.16 -0.05771 -0.05899 44 44 1 5 0 1375.560 26.00 20.00 19.89 32.59 38.9 982.85 -1175 1584 -4949 -1638 -4512 -2279 -1291 -1549 2964 -1602 -2434 -3748 106 1387 -581 -385 -166 2339 182 -180 745 1412 1038 1482 3071 316 404 -1855 2231 193 2876 759 1803 144 -1789 -2399 -3605 151 -581 -770 -1065 -1600 -682 -764 327 154 -846 -1373 -1074 -281 -260 1452 128 926 618 1184 549 -46 351 83 1345 1213 3071 1157 881 -158 -568 -819 866 487 47 947 664 1084 156 -104 -1806 -1849 -846 -1408 -1286 -1772 -2069 -2241 -755 -27 415 678 862 763 152 -221 -434 -172 -205 -714 1091 583 734 -485 -561 -1284 -359 -870 -1175 -666 -655 8 309 1041 445 948 127 371 -62 -100 69 196 471 206 93 -69 262 284 262 -8 -425 -63 290 -92 -317 -168 -395 -99 55 156 634 107 46 -362 -89 -518 -158 226 -768 -235 -611 -287 -166 -219 440 -260 -400 -638 19 276 -132 -95 -43 608 50 -51 213 403 300 444 947 103 130 -586 646 55 831 239 595 49 -604 -803 -1296 60 -271 -407 -614 -971 -422 -479 203 95 -519 -827 -634 -165 -157 914 86 640 440 855 403 -34 255 60 996 948 2520 1006 766 -132 -445 -627 682 420 44 908 642 1015 140 -86 -1394 -1367 -635 -1154 -1154 -1729 -2143 -2433 -853 -32 513 858 1089 941 178 -242 -442 -170 -209 -785 1283 739 972 -645 -715 -1552 -417 -1035 -1474 -875 -894 11 450 1577 699 1492 195 542 -86 -132 90 264 663 304 140 -104 388 407 362 -10 -549 -81 386 -130 -462 -249 -599 -154 89 262 1088 188 81 -631 -152 -863 SS 20250216T145541.4Z 9178.622007 339 1 0.83 2 57.24 118.65 92.54 263.50 0.00 1 0.00 1 0 17 1.043e-02 7.500e-03 7.360e-03 4.466e-03 2.101103e-01 2.409707e-03 2.337612e-03 -6.000000e+00 6.328698e-03 225.25 -2.00 3.11 -2.00 315.42 0.00e+00 2.639753e-04 2.330509e-04 5.708782e-05 -6.000000e+00 2.877715e-04 290.64 -2.00 20.00 -2.00 314.70 0.00e+00 1.842 0.000 302.00 328.00 3 3.2756e+00 6.1444e-03 2.0134e-02 -6.0000e+00 1.5576e-02 3.7910e-02 6.8033e-03 9.6420e-03 -6.0000e+00 1.6782e-02 -3.6210e-03 3.9236e-03 4.7490e-03 -6.0000e+00 1.0071e-02 -3.7764e-03 1.7970e-03 1.3543e-03 -6.0000e+00 4.3894e-03 2.6666e-03 -2.4576e-04 1.4115e-04 2.0416e-05 -6.0000e+00 3.2180e-04 -5.9389e-02 7.2572e-05 12 9 1 12 1 1 999.00 19.90 0.12 -0.05939 -0.06124 2 220 1 5 0 273.170 26.11 19.97 19.90 32.97 38.9 982.89 1583 -2286 104 -2831 328 -3488 -917 119 1595 -2087 -800 -196 -445 -649 -1275 -204 -1417 -1194 3403 799 1113 1435 821 257 698 -249 730 334 1151 2190 981 2884 1127 1041 -1651 -2459 -1951 -670 -497 -1518 324 -1533 -688 105 -533 -316 66 -738 -754 -1050 -172 1370 122 639 781 333 -52 -304 775 536 1532 1411 1239 1236 556 -303 -114 652 325 832 -232 1265 331 -108 -457 728 386 -1304 -815 -1035 -1722 -1424 -2155 -1565 -437 -811 -354 387 -118 -352 598 -12 -70 622 1093 -250 531 543 202 -571 -766 -787 434 -136 -499 -620 -697 -653 949 1028 848 267 228 -222 423 214 900 594 511 -578 -465 -572 -1006 336 157 353 556 494 827 755 -250 -813 295 124 -126 174 -44 121 -46 -357 -94 -649 408 -646 29 -786 83 -869 -230 32 457 -636 -243 -60 -145 -231 -495 -83 -604 -520 1466 358 505 651 377 122 341 -125 363 161 531 984 452 1372 565 529 -835 -1238 -1021 -382 -314 -1054 235 -1161 -528 81 -411 -242 50 -552 -557 -777 -129 1057 98 526 653 283 -45 -261 657 456 1316 1256 1152 1180 532 -282 -102 568 291 787 -232 1287 340 -110 -447 671 338 -1118 -707 -949 -1685 -1465 -2315 -1727 -497 -957 -430 477 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