File name: Pandora141s1_Calakmul_20240811_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20260427T091106.0Z 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 v1.8.88 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20240811_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: 20240811 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 20240811T133948.6Z 8989.569312 95 1 58.50 2 62.71 82.31 140.75 93.57 0.00 1 0.00 1 0 17 5.374e-02 8.871e-03 3.707e-02 7.537e-03 2.687845e-01 4.012770e-03 2.870921e-03 -6.000000e+00 3.264374e-02 227.31 -2.00 3.11 -2.00 318.21 0.00e+00 1.503314e-03 7.627010e-04 2.445013e-04 -6.000000e+00 1.500888e-03 293.76 -2.00 20.00 -2.00 317.28 0.00e+00 2.169 0.000 302.00 328.00 3 7.2056e+00 1.0793e-02 2.4216e-02 -6.0000e+00 8.0616e-02 3.3022e-02 1.2290e-02 1.2386e-02 -6.0000e+00 8.6905e-02 2.3340e-02 7.7136e-03 6.1536e-03 -6.0000e+00 5.2166e-02 -1.6385e-02 3.9366e-03 2.0320e-03 -6.0000e+00 2.2516e-02 3.4379e-05 7.2225e-05 2.4897e-04 2.4338e-05 -6.0000e+00 1.6632e-03 -7.9993e-03 7.7432e-06 11 8 0 10 0 0 99.95 20.91 0.98 -0.00800 -0.00746 16 16 1 5 0 3655.930 26.83 20.00 20.91 35.68 21.5 986.09 -658 53245 3859 16589 -6378 13135 750 -8526 -1497 -2987 -5843 -8142 -6981 545 -455 906 -3002 3342 341 -1013 1353 7485 2895 2175 864 2634 721 -3387 -1303 -2653 219 -51 -1233 -3153 -6721 -2226 -4948 1021 69 -795 1564 -847 -1807 264 -985 -1660 493 -1461 -1906 1526 -1418 1068 3900 -948 400 1523 1290 -1189 -526 -442 2130 1706 1271 -556 1628 -385 361 218 1666 1508 675 662 -67 2291 -482 -440 896 -956 382 48 -1916 -3028 -1818 -1839 567 -818 82 -442 302 322 -1012 -473 -129 758 1370 870 2616 200 444 -468 -1051 -1393 946 -558 -1162 6 -1384 -22 831 453 -631 57 68 205 576 39 168 -325 -688 -121 137 632 474 824 349 78 967 -85 -315 -255 -380 -171 -12 302 -538 419 -174 34 364 -111 208 -720 -46 2421 282 1011 -448 754 52 -716 -127 -267 -545 -826 -792 66 -63 134 -487 534 58 -181 241 1265 525 418 176 539 148 -691 -252 -525 45 -11 -296 -773 -1654 -534 -1345 307 24 -321 666 -386 -852 123 -468 -790 227 -674 -880 698 -704 552 2071 -549 235 905 775 -727 -317 -269 1322 1138 914 -421 1188 -270 239 146 1185 1180 567 572 -58 1854 -373 -311 583 -625 263 37 -1648 -2850 -1793 -1910 612 -944 97 -540 363 372 -1106 -477 -122 715 1364 951 3084 259 592 -615 -1310 -1641 1074 -667 -1476 8 -1928 -31 1246 716 -1038 93 107 303 800 53 229 -464 -1040 -190 217 982 718 1202 492 106 1271 -115 -452 -386 -598 -275 -20 517 -969 775 -331 65 698 -208 379 -1293 SS 20240811T134550.3Z 8989.573499 98 1 30.45 2 61.29 82.69 139.39 93.96 0.00 1 0.00 1 0 17 1.035e-02 5.734e-03 5.332e-03 1.920e-03 2.564652e-01 1.025678e-03 2.773867e-03 -6.000000e+00 6.286881e-03 227.31 -2.00 3.11 -2.00 316.97 0.00e+00 4.947543e-04 1.419344e-04 2.136492e-04 -6.000000e+00 2.889951e-04 293.76 -2.00 20.00 -2.00 316.08 0.00e+00 2.072 0.000 302.00 328.00 3 4.9908e+00 2.6837e-03 2.3115e-02 -6.0000e+00 1.5526e-02 1.9724e-02 3.0073e-03 1.1781e-02 -6.0000e+00 1.6736e-02 9.4723e-03 1.7739e-03 5.7530e-03 -6.0000e+00 1.0046e-02 -8.9392e-03 8.6281e-04 1.6087e-03 -6.0000e+00 4.3372e-03 3.5768e-04 -7.7565e-05 6.1515e-05 2.1580e-05 -6.0000e+00 3.2023e-04 -9.2254e-03 1.5866e-05 12 1 1 12 9 1 99.98 20.91 0.13 -0.00923 -0.00981 20 41 1 5 0 1449.760 26.83 20.00 20.91 35.94 21.5 986.11 -1589 -3303 -3130 -2226 -2941 -3405 1190 -242 510 1331 -3326 -1249 -2357 -117 1534 -266 1798 -370 1367 1134 943 386 530 -82 832 125 415 1264 760 83 1429 2061 57 -1459 -2193 -1723 -1695 -1011 -342 -828 -1032 -874 -182 -600 6 -163 -903 -704 -586 -5 -215 1257 713 216 1090 535 -1 -34 318 848 1377 1879 1446 602 452 -105 12 209 1073 908 448 483 179 57 -56 47 -35 -692 -799 -754 -1380 -1706 -1739 -1533 -839 -168 -22 264 401 316 164 -29 -336 606 248 323 682 -94 -124 -473 -833 -636 -162 -212 -850 -799 -740 -182 502 604 608 331 292 95 80 488 500 550 322 93 120 -1 -183 144 -180 25 416 672 278 381 -376 -566 87 -101 -212 -9 158 14 -47 -48 -201 -359 -201 -453 -431 -286 -353 -403 144 -33 75 200 -529 -205 -435 -24 344 -65 451 -98 369 316 267 111 155 -25 266 41 134 387 225 25 444 683 20 -524 -772 -612 -655 -445 -171 -458 -607 -532 -113 -374 3 -101 -555 -426 -352 -3 -136 829 493 154 792 397 -1 -26 236 630 1053 1507 1225 526 390 -87 9 166 899 819 425 468 173 53 -50 39 -28 -541 -653 -667 -1319 -1734 -1845 -1686 -960 -199 -27 327 491 377 187 -31 -348 623 267 370 831 -122 -163 -616 -1043 -763 -191 -257 -1080 -1052 -1004 -253 721 898 922 503 431 135 109 645 665 754 459 137 178 -1 -266 204 -247 34 545 891 384 546 -556 -851 133 -158 -343 -15 266 25 -81 -80 -332 -583 SS 20240811T135219.6Z 8989.578005 101 1 59.87 2 59.77 83.11 137.92 94.37 0.00 1 0.00 1 0 17 1.686e-02 6.875e-03 1.636e-02 4.639e-03 2.498320e-01 2.469208e-03 2.699338e-03 -6.000000e+00 1.024251e-02 227.31 -2.00 3.11 -2.00 317.68 0.00e+00 1.999179e-04 4.045113e-04 3.320576e-04 -6.000000e+00 4.710486e-04 293.76 -2.00 20.00 -2.00 316.75 0.00e+00 1.977 0.000 302.00 328.00 3 6.5681e+00 6.5499e-03 2.2210e-02 -6.0000e+00 2.5294e-02 6.2606e-02 7.3994e-03 1.1579e-02 -6.0000e+00 2.7269e-02 1.6576e-02 4.4675e-03 5.6109e-03 -6.0000e+00 1.6369e-02 -1.3357e-02 2.2269e-03 1.5882e-03 -6.0000e+00 7.0640e-03 7.9835e-05 -3.5842e-04 1.5174e-04 2.0847e-05 -6.0000e+00 5.2198e-04 -8.0673e-03 -4.1681e-05 11 9 0 11 8 0 99.98 20.91 0.51 -0.00807 -0.01076 60 60 1 5 0 997.660 26.83 20.00 20.91 36.19 21.4 986.24 -547 -1012 1549 1735 3154 -9422 -4242 -5005 1628 1777 -3094 -846 4106 2888 -1992 -3045 -2032 -1391 335 2476 4359 -1374 2828 47 1019 -1633 -397 2127 -714 -332 1668 -20 681 -1738 -5921 -4106 -1556 -687 -335 -1497 -296 -1708 -1139 -180 703 -1167 -1710 211 218 799 545 1849 1043 1742 1747 779 1926 650 331 626 1228 1353 1825 878 761 -203 -370 216 445 -69 152 610 552 420 -789 -268 -1159 -969 -980 -2204 -1909 -1164 -1940 -1065 -1065 -198 639 838 -162 736 -69 -207 -827 -217 22 533 598 290 413 -722 -632 -1123 110 -526 -1080 -638 -162 18 545 999 319 585 49 -157 183 84 302 102 407 47 207 236 406 438 -552 126 -419 556 -95 135 -168 -653 -156 109 -100 31 32 492 -116 333 -489 -481 -53 -105 158 166 275 -909 -418 -553 183 206 -381 -107 554 447 -360 -599 -414 -293 72 536 942 -315 641 12 260 -435 -103 511 -169 -78 407 -5 190 -498 -1709 -1183 -482 -247 -140 -709 -149 -909 -616 -97 376 -631 -913 108 111 413 296 1054 631 1089 1121 515 1271 431 219 415 842 987 1416 708 603 -153 -264 154 341 -58 136 559 502 367 -649 -201 -815 -669 -716 -1797 -1706 -1116 -1979 -1134 -1201 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