File name: Pandora141s1_Calakmul_20241017_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20241018T055141.0Z 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_20241017_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: 20241017 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 20241017T131545.1Z 9056.552605 288 1 60.71 2 71.62 107.24 108.23 288.98 0.00 1 0.00 1 0 17 9.793e-02 1.188e-02 7.642e-02 8.628e-03 3.477477e-01 4.641523e-03 3.781204e-03 -6.000000e+00 5.975131e-02 226.96 -2.00 3.11 -2.00 318.78 0.00e+00 2.084100e-03 1.052577e-03 8.716846e-04 -6.000000e+00 2.729931e-03 292.99 -2.00 20.00 -2.00 317.91 0.00e+00 3.130 0.000 302.00 328.00 3 6.2699e+00 1.2704e-02 3.4120e-02 -6.0000e+00 1.4751e-01 1.7964e-01 1.4673e-02 1.6398e-02 -6.0000e+00 1.5874e-01 1.4502e-02 9.9696e-03 8.2537e-03 -6.0000e+00 9.5271e-02 -1.8395e-02 5.2267e-03 2.5409e-03 -6.0000e+00 4.1421e-02 2.9332e-05 -4.7417e-04 2.8047e-04 3.1960e-05 -6.0000e+00 3.0241e-03 -5.0240e-02 7.4443e-05 12 9 8 11 8 0 99.93 19.85 0.74 -0.05024 -0.05380 26 26 1 5 0 2334.770 26.00 19.98 19.85 30.45 29.7 982.80 66966 -15192 28214 26641 -31909 24798 27343 36384 -4959 -14643 12111 -18071 -27056 13998 393 -292 -8479 455 20990 -7303 512 9345 507 3399 -3039 12077 -3105 -2608 -4994 4337 2735 -5807 -1043 3927 11548 -2837 -6991 230 2784 -3314 -2218 -3016 60 2510 561 1219 -4947 -2656 571 -3857 2979 1281 2186 -342 -710 586 392 -265 1447 2165 288 3011 2332 -284 1217 451 -1895 -10 2109 -115 2324 1418 2728 -264 1735 -661 -2607 -3208 -2142 -2687 -2244 -2633 -2211 -1688 -490 506 -96 1551 2607 1359 -8 -1489 -453 -1855 -916 -952 2154 655 -144 493 -897 -1502 -842 -1292 -1198 -1346 -303 -61 663 1103 2508 344 314 424 -836 -952 201 -435 37 612 197 -160 564 395 518 -137 -1142 595 -261 -874 -346 -518 -809 211 153 316 629 378 -17 625 -157 -1108 1382 -747 966 897 -1723 764 860 1165 -256 -874 580 -1213 -2243 927 34 -29 -969 51 2022 -956 64 1082 65 447 -449 1602 -475 -385 -732 586 402 -1024 -191 710 1901 -533 -1468 52 729 -1057 -770 -1118 22 932 214 463 -1986 -1036 217 -1561 1195 560 1011 -170 -368 309 210 -143 757 1122 157 1709 1446 -191 817 293 -1195 -6 1355 -83 1778 1139 2163 -207 1251 -446 -1655 -1993 -1385 -1944 -1807 -2336 -2092 -1676 -509 551 -110 1801 2989 1527 -8 -1501 -424 -1740 -898 -1024 2487 836 -195 661 -1156 -1812 -969 -1515 -1480 -1754 -409 -86 980 1724 4057 576 515 660 -1237 -1349 281 -632 56 967 317 -256 872 590 743 -189 -1548 804 -375 -1350 -560 -867 -1394 374 284 611 1242 759 -35 1228 -300 -2067 SS 20241017T132146.6Z 9056.556789 291 1 60.16 2 70.26 107.87 109.51 289.62 0.00 1 0.00 1 0 17 2.005e-02 5.434e-03 1.619e-02 2.456e-03 3.292599e-01 1.318205e-03 3.530356e-03 -6.000000e+00 1.223431e-02 226.96 -2.00 3.11 -2.00 318.63 0.00e+00 5.543178e-04 2.844719e-04 4.358359e-04 -6.000000e+00 5.588973e-04 292.99 -2.00 20.00 -2.00 317.75 0.00e+00 2.927 0.000 302.00 328.00 3 4.7192e+00 3.5893e-03 3.1953e-02 -6.0000e+00 3.0203e-02 5.7899e-02 4.1198e-03 1.5376e-02 -6.0000e+00 3.2500e-02 8.9441e-03 2.7354e-03 7.5133e-03 -6.0000e+00 1.9506e-02 -1.0839e-02 1.4288e-03 2.1141e-03 -6.0000e+00 8.4823e-03 1.8455e-04 -2.0042e-04 8.0118e-05 2.6809e-05 -6.0000e+00 6.1909e-04 -5.2121e-02 4.1687e-05 11 1 0 11 8 0 99.97 19.85 0.17 -0.05212 -0.05363 110 110 1 5 0 546.790 26.00 20.02 19.85 30.85 29.7 982.93 -3423 8700 -3353 -1025 -8155 -8695 1709 1063 208 -10679 4174 -2472 -3359 -3389 -3033 1448 -1891 -151 -1245 3345 -260 2316 1771 2371 -864 -1333 84 -3402 -296 852 1526 831 1396 -2054 -2973 -2230 -2014 906 22 15 -823 -346 -1064 -1781 -1287 -250 -396 -1395 -556 -238 55 480 1418 224 1212 916 160 612 368 760 1189 1343 1632 952 550 164 -493 383 1376 1518 1042 778 258 288 -75 47 -1136 -440 -736 -1529 -1165 -1747 -1330 -1549 -988 -542 54 278 567 682 576 413 -383 95 37 208 519 336 90 -261 -665 -1035 -438 -153 -959 -846 -885 -213 273 806 409 379 223 -217 168 241 140 389 188 -6 178 -51 65 245 41 70 294 680 332 -129 -362 -234 -57 40 -259 -50 371 90 81 -185 -79 -415 -155 389 -174 -50 -398 -412 77 54 12 -707 248 -164 -253 -296 -303 154 -223 -18 -161 431 -36 313 247 347 -138 -222 14 -558 -46 130 246 148 267 -419 -598 -445 -432 219 6 5 -300 -133 -426 -728 -527 -102 -160 -564 -223 -97 24 220 686 115 640 498 89 339 203 416 669 803 1050 650 380 109 -315 241 913 1105 820 638 213 230 -57 32 -741 -277 -487 -1126 -949 -1558 -1259 -1545 -1035 -596 61 325 663 775 619 416 -367 90 36 224 609 427 119 -347 -850 -1247 -508 -179 -1193 -1105 -1203 -300 402 1246 659 620 358 -335 244 338 196 561 284 -10 286 -81 101 370 59 98 403 938 483 -200 -585 -389 -96 70 -476 -96 718 178 159 -359 -150 -768 SS 20241017T134152.8Z 9056.570750 300 1 10.82 2 65.75 110.11 113.73 291.87 0.00 1 0.00 1 0 17 2.288e-02 8.345e-03 1.726e-02 5.698e-03 2.757624e-01 3.055940e-03 2.986964e-03 -6.000000e+00 1.396078e-02 226.96 -2.00 3.11 -2.00 317.07 0.00e+00 6.536975e-04 4.340405e-04 2.208310e-04 -6.000000e+00 6.377645e-04 292.99 -2.00 20.00 -2.00 316.21 0.00e+00 2.418 0.000 302.00 328.00 3 5.4092e+00 7.9877e-03 2.6436e-02 -6.0000e+00 3.4466e-02 8.0647e-02 8.9425e-03 1.2704e-02 -6.0000e+00 3.7087e-02 -1.1906e-03 5.3300e-03 6.2060e-03 -6.0000e+00 2.2259e-02 -2.5215e-03 2.6347e-03 1.7585e-03 -6.0000e+00 9.6789e-03 1.6016e-04 -7.0887e-05 1.8116e-04 2.2899e-05 -6.0000e+00 7.0646e-04 -5.1259e-02 6.8109e-05 12 9 1 12 1 1 999.00 19.85 0.48 -0.05126 -0.05179 2 17 1 5 0 3605.420 26.00 19.98 19.85 31.86 29.6 983.21 7178 -4142 -3721 194 -6692 1399 9013 -5559 -1486 -9822 -4202 -6633 5558 -2424 5505 -1080 5508 -680 -2443 626 -1291 1894 2354 3180 1071 2393 4072 -562 -699 -1413 579 3035 1473 -2420 -6272 -2889 -3716 -811 -618 804 -1238 -167 -713 -845 114 -772 1065 -415 -95 -656 -1381 1523 -121 -724 1065 1422 423 -152 -691 410 562 1913 1968 1073 1435 400 140 -162 1264 1395 885 -292 1505 345 356 506 -1734 -1937 -1635 -1731 -1147 -525 -1613 -1378 -1034 -605 23 103 1418 982 487 -917 104 -300 -1625 183 353 240 577 -128 -803 -1387 327 -329 -1228 -1075 -499 -16 715 672 392 935 249 -238 113 -239 -459 389 496 504 -519 438 -21 18 113 453 311 -1 496 -68 360 -404 -124 201 218 624 113 -25 -266 -81 -84 -1118 737 -516 -474 23 -775 144 905 -706 -199 -1491 -616 -1031 853 -454 1082 -246 1248 -169 -639 165 -352 506 637 892 321 729 1218 -169 -202 -406 171 941 492 -852 -2227 -991 -1368 -331 -289 416 -701 -98 -430 -515 69 -471 633 -246 -56 -391 -859 975 -82 -512 762 1034 313 -113 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