File name: Pandora141s1_Calakmul_20241125_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20241126T055934.9Z 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_20241125_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: 20241125 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 20241125T132703.4Z 9095.560456 233 1 59.46 2 74.44 118.98 19.38 168.37 0.00 1 0.00 1 0 25 8.027e-02 6.972e-03 7.650e-02 4.966e-03 4.068967e-01 2.696821e-03 4.397841e-03 -6.000000e+00 4.879501e-02 225.64 -2.00 3.11 -2.00 319.62 0.00e+00 1.666398e-03 7.993948e-04 8.489436e-04 -6.000000e+00 2.225427e-03 291.78 -2.00 20.00 -2.00 318.82 0.00e+00 3.661 0.000 302.00 328.00 3 5.1389e+00 7.7208e-03 3.9927e-02 -6.0000e+00 1.2015e-01 4.5007e-02 9.2104e-03 1.9307e-02 -6.0000e+00 1.2937e-01 1.6343e-02 7.0325e-03 9.7041e-03 -6.0000e+00 7.7675e-02 -1.7197e-02 3.6835e-03 2.8705e-03 -6.0000e+00 3.3885e-02 5.5229e-05 -9.1070e-04 1.6208e-04 3.9212e-05 -6.0000e+00 2.4768e-03 -6.2150e-02 8.0076e-05 11 9 0 11 8 0 99.96 19.96 0.26 -0.06215 -0.06899 33 33 1 5 0 1801.410 26.11 20.01 19.96 28.31 32.8 987.52 7604 7624 1010 -20116 -27624 7987 -7147 38137 -17195 -36937 -25387 33403 -30494 -4274 -18276 20995 -12431 4951 -3174 -3683 9349 -2225 -6958 -552 -6750 1117 -703 -1627 55 10941 -1330 -96 -1872 -4465 -3937 -3140 -667 -4037 -1251 -593 1141 1748 -743 -955 658 -2229 -1151 1339 -363 3333 -168 1489 432 614 1005 -1058 728 -1518 2451 973 2922 1428 3453 3261 1409 419 -825 1261 825 68 1213 89 132 -80 882 -980 -1499 -958 -1415 -1178 -1579 -1150 -2640 -1884 -203 -499 -274 354 455 280 846 280 -628 31 186 176 375 302 964 -130 -994 -1808 -559 -56 -1196 -650 -612 -224 494 809 748 690 745 -120 934 -191 -159 -26 -451 170 -286 9 99 111 545 -274 341 -271 45 57 -514 -206 -20 98 23 -4 183 88 153 165 -562 -90 120 137 20 -489 -677 136 -147 575 -482 -1331 -858 701 -1328 -174 -998 907 -805 292 -214 -262 610 -164 -552 -44 -605 98 -63 -144 5 855 -126 -10 -222 -571 -496 -391 -87 -631 -226 -124 262 427 -194 -256 176 -619 -318 362 -101 926 -51 486 153 231 394 -437 303 -646 996 400 1214 644 1673 1699 767 225 -429 642 449 41 793 62 92 -54 553 -576 -821 -510 -797 -740 -1120 -898 -2252 -1688 -190 -494 -285 376 484 292 830 259 -553 27 170 178 418 369 1243 -170 -1256 -2149 -627 -63 -1428 -815 -801 -307 711 1240 1209 1146 1225 -191 1400 -278 -230 -39 -706 276 -473 15 159 172 815 -398 480 -388 68 92 -886 -368 -36 186 46 -9 389 191 331 351 -1168 -180 SS 20241125T133628.8Z 9095.567000 236 1 6.88 2 72.50 120.06 19.10 175.39 0.00 1 0.00 1 0 17 3.329e-02 6.837e-03 3.178e-02 4.167e-03 3.721435e-01 2.231678e-03 3.954782e-03 -6.000000e+00 2.025796e-02 225.64 -2.00 3.11 -2.00 318.48 0.00e+00 7.167484e-04 4.715295e-04 2.338015e-04 -6.000000e+00 9.234300e-04 291.78 -2.00 20.00 -2.00 317.63 0.00e+00 3.278 0.000 302.00 328.00 3 3.7764e+00 6.0316e-03 3.5775e-02 -6.0000e+00 4.9886e-02 -1.1511e-02 6.9014e-03 1.7123e-02 -6.0000e+00 5.3690e-02 2.1481e-02 4.6768e-03 8.4468e-03 -6.0000e+00 3.2237e-02 -1.3426e-02 2.4734e-03 2.4986e-03 -6.0000e+00 1.4082e-02 3.3166e-04 2.3256e-04 1.3238e-04 3.0664e-05 -6.0000e+00 1.0269e-03 -6.6259e-02 2.5645e-04 12 9 1 12 9 1 89.49 19.95 0.21 -0.06626 -0.06451 7 70 1 5 0 859.020 26.11 20.01 19.95 28.97 32.7 987.62 -5256 -5244 4348 -5584 -25247 -5005 43 12645 12631 6259 -3675 -658 978 -8470 2750 -7095 4474 -4841 -1244 110 -5171 380 42 3276 609 -1177 301 338 1993 -1109 3428 1933 4055 -1017 851 -3215 1342 -1353 -1942 -3556 -530 -43 -1668 -1079 -570 -192 -1532 -1352 319 372 785 635 2041 542 473 412 85 398 -328 1804 754 1392 2523 2476 641 -232 132 -1184 1296 802 281 496 664 71 473 825 -1575 -265 -621 -259 -996 -1840 -2061 -2349 -1499 -931 382 488 592 448 792 197 -906 443 103 200 563 369 -175 530 -945 -926 4 69 -591 -502 -755 -387 394 866 418 11 262 293 -65 321 311 1049 192 -578 -386 -663 -248 408 569 -180 471 570 36 -419 158 -196 -126 134 -111 339 275 -54 81 -238 -142 -428 -193 -217 174 -241 -1227 -194 2 486 543 306 -205 -38 63 -694 237 -754 465 -583 -153 14 -711 50 6 460 93 -192 49 54 302 -174 549 347 781 -214 174 -679 290 -342 -577 -1226 -196 -17 -683 -448 -238 -80 -649 -571 134 160 352 304 1028 290 263 235 50 232 -191 1031 444 860 1657 1716 459 -163 89 -805 907 611 229 419 563 59 375 612 -1117 -182 -443 -201 -848 -1699 -2016 -2401 -1590 -1028 433 566 688 512 868 206 -913 439 106 220 668 468 -233 704 -1228 -1145 5 83 -739 -652 -1015 -537 566 1299 653 17 413 448 -95 458 442 1516 288 -902 -609 -1045 -383 616 837 -258 661 805 53 -650 255 -324 -213 233 -199 625 517 -104 154 -449 -263 -776 SS 20241125T134212.8Z 9095.570981 240 1 8.94 2 71.33 120.74 19.07 179.72 0.00 1 0.00 1 0 17 1.292e-02 5.320e-03 4.332e-03 7.823e-04 3.519049e-01 4.185690e-04 3.791435e-03 -6.000000e+00 7.855358e-03 225.63 -2.00 3.11 -2.00 318.08 0.00e+00 5.337801e-04 7.799622e-05 2.635622e-04 -6.000000e+00 3.582075e-04 291.78 -2.00 20.00 -2.00 317.22 0.00e+00 3.085 0.000 302.00 328.00 3 1.1377e+00 1.1174e-03 3.3720e-02 -6.0000e+00 1.9343e-02 -3.1111e-02 1.2664e-03 1.6219e-02 -6.0000e+00 2.0826e-02 1.3235e-02 8.1747e-04 7.9727e-03 -6.0000e+00 1.2504e-02 -9.8650e-03 4.2616e-04 2.2702e-03 -6.0000e+00 5.4560e-03 5.7976e-03 -5.4246e-04 2.4836e-05 2.8945e-05 -6.0000e+00 3.9865e-04 -6.3466e-02 8.6358e-05 12 1 1 12 1 1 93.55 19.94 0.16 -0.06347 -0.06754 185 1245 1 5 0 48.050 26.11 20.00 19.94 29.41 33.0 987.72 -1164 476 -1221 -3500 -1886 -6023 -1617 -4867 -512 -3979 -3630 -5092 -2823 -321 -1234 816 -455 406 -315 890 557 91 1264 88 1057 416 44 -590 56 -43 671 2386 622 -828 -3137 -2070 -2860 -1616 -703 -804 -482 -860 -667 -623 -220 -6 -496 -523 -576 -45 307 773 731 879 469 627 700 276 319 341 1177 1341 2004 1358 998 292 -192 137 958 1006 493 379 409 250 25 -137 -509 -785 -759 -892 -1193 -1524 -1800 -1664 -1192 -567 -287 199 134 433 409 426 116 523 439 274 508 392 -14 -262 -581 -934 -284 -168 -681 -697 -843 -316 133 681 475 367 233 56 248 374 430 478 302 -201 -217 -230 -109 31 140 61 319 563 536 340 -76 -261 -234 -7 -119 -82 98 72 -1 -121 -95 -374 -59 27 -73 -208 -103 -327 -88 -307 -35 -298 -280 -422 -259 -34 -141 103 -63 59 -49 143 92 15 216 16 205 85 9 -118 11 -8 137 530 154 -217 -828 -536 -740 -481 -248 -309 -206 -394 -317 -302 -107 -3 -242 -254 -280 -22 150 406 413 526 276 381 435 172 197 210 739 901 1459 1004 755 215 -134 101 698 817 416 336 365 216 20 -107 -367 -582 -555 -732 -1049 -1417 -1817 -1696 -1289 -620 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