File name: Pandora141s1_Calakmul_20241027_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20241028T055413.4Z 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_20241027_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: 20241027 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 20241027T140438.6Z 9066.586558 237 1 12.55 2 62.11 116.62 10.64 150.05 0.00 1 0.00 1 0 17 1.489e-02 7.270e-03 1.103e-02 4.399e-03 2.419125e-01 2.360039e-03 2.651662e-03 -6.000000e+00 9.076565e-03 226.62 -2.00 3.11 -2.00 316.67 0.00e+00 6.033323e-04 3.026656e-04 1.852169e-04 -6.000000e+00 4.145589e-04 292.69 -2.00 20.00 -2.00 315.83 0.00e+00 2.127 0.000 302.00 328.00 3 5.5380e+00 6.1298e-03 2.3245e-02 -6.0000e+00 2.2393e-02 3.6559e-02 6.8379e-03 1.1149e-02 -6.0000e+00 2.4102e-02 1.0552e-02 4.0108e-03 5.4571e-03 -6.0000e+00 1.4467e-02 -7.7567e-03 1.9399e-03 1.5510e-03 -6.0000e+00 6.2930e-03 1.9934e-04 1.3401e-04 1.4032e-04 2.1031e-05 -6.0000e+00 4.5975e-04 -4.9732e-02 1.4543e-04 12 9 1 12 1 1 98.67 19.84 0.24 -0.04973 -0.04873 3 19 1 5 0 3135.530 26.00 19.98 19.84 33.83 31.8 988.20 5973 -4964 1713 -5240 -3486 4018 -3700 -184 -726 4077 -3514 -808 -3045 2702 36 -229 -1000 -784 2181 -2114 938 1524 1168 2121 998 -752 -640 2010 -249 2475 -898 1319 342 -35 -2865 -2664 -2788 -1664 -315 -730 -1076 -982 -553 -900 -593 491 -637 913 -552 306 500 -215 1268 286 1860 518 699 848 -201 841 -49 1708 2017 1472 229 354 -964 205 744 1521 232 563 643 -305 -623 213 -272 565 -933 -1551 -1280 -1634 -2247 -2002 -323 229 112 394 -611 -267 22 -708 855 677 52 199 681 551 -53 -396 -594 -713 -563 244 -1386 -555 -589 -982 1051 203 434 978 259 212 169 302 275 352 129 3 109 332 190 -271 128 -218 766 327 1073 234 179 -376 -483 33 134 -344 -183 8 -141 145 -286 -416 800 -796 264 -824 -498 514 -528 -28 -122 683 -637 -147 -618 586 9 -62 -283 -229 642 -664 293 476 372 696 345 -271 -229 679 -82 786 -303 466 129 -13 -1098 -1013 -1127 -753 -161 -417 -660 -627 -360 -593 -390 320 -413 576 -348 193 325 -147 897 211 1386 397 540 653 -155 645 -39 1393 1731 1311 206 304 -799 166 626 1365 222 555 634 -296 -579 185 -223 446 -763 -1368 -1213 -1653 -2388 -2204 -366 270 137 490 -764 -326 26 -787 893 697 56 224 815 698 -69 -519 -753 -865 -667 293 -1747 -723 -790 -1360 1483 299 652 1473 384 302 230 398 362 474 181 5 160 487 275 -384 176 -291 995 427 1440 328 259 -555 -724 50 212 -559 -303 13 -237 241 -467 -667 SS 20241027T153904.3Z 9066.652133 293 1 60.53 2 43.76 134.19 19.91 243.42 0.00 1 0.00 1 0 17 8.639e-03 6.767e-03 2.817e-03 1.719e-03 1.655001e-01 9.296346e-04 1.839401e-03 -6.000000e+00 5.263386e-03 226.62 -2.00 3.11 -2.00 315.39 0.00e+00 4.126361e-04 8.957611e-05 1.114367e-04 -6.000000e+00 2.405083e-04 292.69 -2.00 20.00 -2.00 314.64 0.00e+00 1.383 0.000 302.00 328.00 3 6.1787e+00 2.3782e-03 1.5292e-02 -6.0000e+00 1.2985e-02 4.9745e-02 2.6316e-03 7.5859e-03 -6.0000e+00 1.3978e-02 3.4531e-03 1.5144e-03 3.7200e-03 -6.0000e+00 8.3897e-03 -5.4527e-03 6.9022e-04 1.0504e-03 -6.0000e+00 3.6487e-03 2.4477e-04 -2.4704e-04 5.4635e-05 1.6233e-05 -6.0000e+00 2.6676e-04 -5.0983e-02 1.9150e-05 12 9 1 12 1 1 99.95 19.84 0.17 -0.05098 -0.05284 17 18 1 5 0 3362.320 26.00 19.98 19.84 35.33 32.0 988.48 322 473 -443 -2320 -1792 -1806 -94 796 616 -982 -1175 -667 -442 192 288 72 -621 984 921 1011 579 1179 898 983 730 504 299 -618 1012 165 581 1599 715 -557 -2575 -3215 -2356 -438 -365 -560 -850 -588 -405 -533 -382 -768 -844 -804 -732 -164 -147 525 688 915 1163 795 565 223 233 719 841 1326 1984 1295 912 -220 -332 -120 601 1376 448 714 471 364 23 -548 -695 -1328 -880 -1104 -1436 -1596 -1830 -1881 -815 -286 -58 174 272 522 268 94 -367 10 -500 352 472 721 199 -90 -519 -1026 -432 -415 -903 -872 -801 -194 659 1046 940 614 335 60 33 -106 19 378 209 56 10 224 196 12 245 198 -40 393 332 192 -333 -416 -256 124 67 -195 392 118 66 -306 -44 -691 88 137 -130 -656 -463 -443 -23 215 180 -301 -360 -205 -145 69 112 30 -267 426 407 456 266 539 415 468 361 255 150 -298 458 73 260 742 348 -276 -1256 -1558 -1199 -247 -233 -396 -642 -459 -322 -426 -305 -609 -657 -611 -544 -120 -110 409 556 759 981 681 489 193 200 616 736 1207 1886 1270 888 -206 -293 -103 533 1301 451 740 491 371 23 -503 -596 -1099 -738 -990 -1386 -1639 -1967 -2096 -941 -344 -72 221 345 646 317 105 -386 10 -525 387 553 891 255 -115 -639 -1211 -498 -488 -1112 -1117 -1056 -262 910 1487 1365 894 476 82 43 -131 23 479 276 77 14 314 271 16 320 250 -49 481 418 250 -447 -567 -353 175 98 -292 598 183 102 -473 -67 -1034 SS 20241027T154455.5Z 9066.656198 296 1 14.07 2 42.77 135.70 21.16 245.40 0.00 1 0.00 1 0 17 7.830e-03 6.272e-03 3.181e-03 2.156e-03 1.619992e-01 1.172659e-03 1.792042e-03 -6.000000e+00 4.770927e-03 226.62 -2.00 3.11 -2.00 314.93 0.00e+00 1.596468e-04 1.031481e-04 7.635363e-05 -6.000000e+00 2.179992e-04 292.69 -2.00 20.00 -2.00 314.23 0.00e+00 1.361 0.000 302.00 328.00 3 5.3871e+00 2.9855e-03 1.5023e-02 -6.0000e+00 1.1770e-02 4.0410e-02 3.2949e-03 7.4109e-03 -6.0000e+00 1.2670e-02 1.4965e-04 1.8966e-03 3.6390e-03 -6.0000e+00 7.6046e-03 -3.9880e-03 8.5188e-04 1.0312e-03 -6.0000e+00 3.3075e-03 5.5909e-04 -2.3962e-04 6.8176e-05 1.6312e-05 -6.0000e+00 2.4179e-04 -5.1614e-02 6.3645e-06 12 1 1 12 9 1 99.99 19.84 0.19 -0.05161 -0.05341 12 55 1 5 0 1081.600 26.00 20.00 19.84 35.59 32.0 988.52 -80 -285 165 -1949 -1093 -1584 1066 657 927 -616 -863 -1221 -502 167 -342 -56 78 1046 505 371 950 405 377 800 1194 511 150 -281 758 334 964 2448 742 -1271 -2098 -1170 -1994 -805 -94 -1100 -618 -879 -340 -1042 -359 -1058 -615 -1151 -607 100 263 158 434 1199 1024 1132 643 426 404 497 1071 1435 1750 1146 558 92 -618 261 1146 608 97 862 497 76 126 -727 -938 -932 -744 -1230 -1266 -1530 -1905 -1493 -754 -520 -268 348 -80 467 386 -272 -70 110 182 237 445 364 -91 -40 -490 -497 155 112 -733 -734 -485 -207 318 952 514 533 -8 -142 103 499 436 210 284 -57 -171 -5 229 110 -53 182 293 542 434 -15 -220 -225 -210 4 -173 124 103 -79 124 -414 29 -456 -26 -98 57 -648 -334 -464 314 210 319 -221 -309 -442 -191 69 -152 -26 38 508 250 188 485 208 195 424 651 285 83 -150 383 165 479 1251 398 -695 -1123 -616 -1109 -492 -64 -825 -488 -717 -281 -870 -297 -875 -498 -915 -471 77 206 129 363 1025 891 996 571 379 357 439 962 1334 1694 1140 552 87 -559 230 1036 587 99 898 520 79 124 -682 -828 -794 -642 -1128 -1237 -1582 -2051 -1656 -866 -620 -329 435 -101 572 454 -304 -73 113 191 261 518 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