File name: Pandora141s1_Calakmul_20241121_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20241122T061112.0Z 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_20241121_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: 20241121 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 20241121T130247.1Z 9091.543600 282 1 23.54 2 78.95 115.78 29.83 279.86 0.00 1 0.00 1 0 17 1.622e-01 5.098e-03 1.022e-01 2.211e-03 5.344800e-01 1.221066e-03 5.610881e-03 -6.000000e+00 9.864824e-02 225.77 -2.00 3.11 -2.00 320.30 0.00e+00 2.317657e-03 4.706069e-04 5.677623e-04 -6.000000e+00 4.498584e-03 291.91 -2.00 20.00 -2.00 319.58 0.00e+00 5.031 0.001 302.00 328.00 3 1.8535e+00 3.7642e-03 5.4173e-02 -6.0000e+00 2.4298e-01 -3.3163e-02 4.7718e-03 2.5056e-02 -6.0000e+00 2.6157e-01 1.4432e-02 4.2076e-03 1.3182e-02 -6.0000e+00 1.5704e-01 -1.2052e-02 2.1400e-03 4.7820e-03 -6.0000e+00 6.8518e-02 3.8234e-04 -8.0187e-04 6.9060e-05 5.9051e-05 -6.0000e+00 5.0037e-03 -6.3596e-02 8.9422e-05 12 1 1 12 9 1 99.63 19.95 0.19 -0.06360 -0.06962 89 229 1 5 0 261.440 26.11 20.02 19.95 28.45 33.3 986.13 60455 -80415 -27229 -46674 -51713 -53845 -87488 12441 -55975 -4135 -50791 -24 -35564 -3823 6045 -17619 3351 -16589 8465 -14903 574 -6281 -6765 206 -14089 -704 -16720 8799 -12516 4272 -4058 2225 -3295 -3234 522 -9913 -236 -9080 1775 -1072 -660 -560 -1830 1052 -2347 1451 -2133 364 -1780 936 2365 2297 2135 -316 1032 541 1794 -1591 673 -482 -71 2430 2413 2768 603 1418 -53 886 994 839 1221 802 702 -24 -199 -106 -236 -739 -1155 -596 -1023 -734 -2347 -1304 -1287 -589 -114 466 715 646 852 319 525 107 384 219 254 398 -276 -201 -425 -747 -350 -177 -739 -907 -896 -377 66 512 510 -7 314 -105 165 319 315 410 -112 -100 -38 63 -109 24 108 -37 670 54 433 109 23 -450 -96 137 -214 10 28 226 28 -71 -229 -89 156 -914 -217 -412 -502 -522 -1149 75 -691 -37 -697 0 -565 -55 98 -432 76 -504 217 -514 18 -212 -239 7 -627 -29 -829 335 -586 177 -208 125 -223 -235 37 -775 -18 -900 192 -130 -90 -83 -292 168 -397 241 -375 64 -331 180 488 526 537 -88 301 166 560 -517 211 -153 -23 841 932 1083 253 586 -22 366 446 425 680 472 416 -14 -106 -52 -107 -334 -569 -336 -670 -504 -1798 -1060 -1117 -542 -103 432 663 623 775 273 427 88 344 208 276 485 -342 -252 -509 -879 -385 -195 -864 -1129 -1107 -494 93 745 806 -12 521 -169 251 493 486 618 -179 -167 -65 105 -175 37 170 -56 987 82 673 188 41 -849 -189 270 -451 22 65 496 61 -161 -495 -184 SS 20241121T130821.0Z 9091.547465 285 1 17.14 2 77.77 116.34 31.10 279.88 0.00 1 0.00 1 0 25 1.983e-01 8.842e-03 2.571e-01 7.861e-03 4.916023e-01 4.396995e-03 5.219758e-03 -6.000000e+00 1.207165e-01 225.77 -2.00 3.11 -2.00 320.46 0.00e+00 2.159417e-03 1.730410e-03 1.070026e-03 -6.000000e+00 5.571357e-03 291.91 -2.00 20.00 -2.00 319.74 0.00e+00 4.581 0.000 302.00 328.00 3 3.8069e+00 1.3775e-02 4.9581e-02 -6.0000e+00 2.9737e-01 -3.6526e-02 1.7419e-02 2.3518e-02 -6.0000e+00 3.1999e-01 2.6620e-02 1.5000e-02 1.2345e-02 -6.0000e+00 1.9225e-01 -1.3200e-02 7.5829e-03 4.0175e-03 -6.0000e+00 8.4217e-02 8.5008e-05 -4.1694e-04 2.5666e-04 5.6646e-05 -6.0000e+00 6.1231e-03 -6.4094e-02 3.0829e-04 12 9 1 12 1 1 100.00 19.94 0.20 -0.06409 -0.06723 57 203 1 5 0 295.360 26.11 20.00 19.94 28.71 33.3 986.19 -51442 92431 900000 24438 71203 63371 -47523 15520 -57550 -29961 -50748 3956 -12883 -27814 69333 -60007 71322 -45704 42066 28151 18274 11476 -7952 25571 -17691 12202 -668 -6271 1369 -13962 7786 -7584 -440 -17931 6535 -15591 17808 -4814 -773 6231 1674 6545 -1988 3902 3449 1524 -5971 5556 -7020 -2911 3154 -3103 4927 3336 4432 2274 462 603 -2766 3234 -2365 3383 -1634 5115 -190 2308 2006 1163 2730 -1710 -1222 237 2268 -3049 -1953 -934 -65 3361 -3282 624 -290 -261 -1054 -2020 -1745 -666 576 681 717 498 1294 505 19 -1172 8 716 -482 227 427 358 -732 -1083 -843 -79 -772 -1006 -692 -934 934 455 936 423 292 650 -585 660 -639 608 -395 -32 470 -1110 689 -276 1037 -771 432 -281 496 268 -56 -307 -763 177 -542 177 160 235 171 297 165 -673 -527 708 900000 187 546 486 -580 119 -968 -425 -921 48 -212 -636 794 -2557 1046 -2082 937 752 554 378 -322 818 -897 500 -31 -306 62 -748 379 -485 -30 -1507 441 -1288 1165 -447 -82 730 229 927 -320 615 556 254 -1084 924 -1347 -564 622 -709 1138 839 1164 635 135 177 -830 917 -728 1062 -594 1902 -78 909 772 455 1131 -822 -640 129 1219 -1666 -992 -433 -28 1381 -1529 318 -169 -170 -753 -1547 -1416 -567 511 623 658 448 1099 407 14 -917 6 655 -499 259 520 441 -875 -1209 -890 -83 -857 -1184 -852 -1218 1280 675 1478 695 481 1033 -897 966 -943 916 -628 -53 783 -1848 1103 -433 1561 -1140 618 -412 772 453 -102 -583 -1511 363 -1173 398 370 550 401 685 369 -1458 SS 20241121T131353.7Z 9091.551316 288 1 60.01 2 76.59 116.92 32.37 279.91 0.00 1 0.00 1 0 17 5.855e-02 4.427e-03 3.533e-02 1.573e-03 4.600075e-01 8.604477e-04 4.881042e-03 -6.000000e+00 3.561623e-02 225.77 -2.00 3.11 -2.00 319.97 0.00e+00 1.160000e-03 2.911509e-04 6.486159e-04 -6.000000e+00 1.624214e-03 291.91 -2.00 20.00 -2.00 319.21 0.00e+00 4.207 0.000 302.00 328.00 3 2.7361e+00 2.5467e-03 4.5646e-02 -6.0000e+00 8.7726e-02 -3.4228e-02 3.1200e-03 2.1661e-02 -6.0000e+00 9.4439e-02 2.6318e-02 2.5708e-03 1.0924e-02 -6.0000e+00 5.6700e-02 -1.7301e-02 1.3320e-03 3.2631e-03 -6.0000e+00 2.4737e-02 3.6349e-04 -6.5224e-04 5.0521e-05 4.3248e-05 -6.0000e+00 1.8066e-03 -6.3100e-02 9.9482e-05 10 0 0 10 0 0 99.97 19.93 0.20 -0.06310 -0.06800 224 224 1 5 0 267.870 26.11 20.00 19.93 28.97 33.3 986.23 -28563 -23658 -14839 -23298 -3936 -18548 -17633 -16922 -20380 -7301 -22637 4466 -12936 -7356 -2372 -3311 -1324 -6265 6531 -7431 3833 -655 -1900 1031 -520 1625 433 2314 -5071 3811 -806 1287 1039 -1721 -1842 -3246 -1319 -2058 1155 -1355 -1293 -1197 -2441 -369 -1141 -841 -1538 203 -1235 378 -377 761 1487 381 1163 706 762 -188 100 514 793 1785 2140 1739 881 819 -358 186 704 1211 614 328 701 128 259 -752 -440 -1048 -962 -655 -806 -1216 -1852 -1428 -713 -595 -103 229 307 557 374 183 118 484 204 415 562 448 115 -153 -391 -806 -206 -39 -910 -766 -940 -284 170 697 687 213 384 35 -35 185 412 389 61 -94 -381 -176 -97 159 170 -54 231 275 367 84 -68 -411 -380 -99 -269 -8 93 90 70 151 4 -100 -350 -319 -197 -333 -45 -235 -235 -252 -353 -121 -457 76 -302 -197 -72 -118 -51 -275 272 -372 179 -33 -99 56 -31 100 27 142 -328 233 -57 101 91 -164 -175 -313 -135 -247 161 -226 -241 -240 -518 -79 -250 -186 -346 46 -287 90 -97 212 446 123 393 249 276 -69 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