File name: Pandora141s1_Calakmul_20241119_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20241120T054858.0Z 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_20241119_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: 20241119 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 20241119T131828.6Z 9089.554498 294 1 26.26 2 75.33 117.05 56.92 291.04 0.00 1 0.00 1 0 25 2.882e-02 5.046e-03 1.531e-02 1.281e-03 4.193650e-01 6.906579e-04 4.487368e-03 -6.000000e+00 1.753544e-02 225.84 -2.00 3.11 -2.00 319.10 0.00e+00 9.694842e-04 1.766344e-04 4.991777e-04 -6.000000e+00 7.996956e-04 291.98 -2.00 20.00 -2.00 318.27 0.00e+00 3.867 0.000 302.00 328.00 3 2.2107e+00 1.9163e-03 4.1850e-02 -6.0000e+00 4.3197e-02 1.2914e-03 2.2392e-03 1.9596e-02 -6.0000e+00 4.6500e-02 1.1680e-02 1.6486e-03 9.6827e-03 -6.0000e+00 2.7918e-02 -1.1089e-02 8.7514e-04 2.7866e-03 -6.0000e+00 1.2179e-02 8.6770e-04 -8.9626e-04 4.0641e-05 3.5542e-05 -6.0000e+00 8.8927e-04 -6.3732e-02 7.6137e-05 12 1 1 12 9 1 99.97 19.94 0.20 -0.06373 -0.07047 119 274 1 5 0 218.770 26.00 20.00 19.94 33.35 33.6 978.21 -7613 -10258 -4573 -10483 -16564 -5026 -8784 -5433 -10068 -1462 -9578 -887 -1644 -7031 1934 -3357 2149 -4176 3784 953 3232 -87 -2133 1061 -2081 309 -1056 1074 -2038 -1595 1780 121 739 -2433 -2089 -3590 -2097 -1151 -1112 -2547 -1913 -984 -933 76 -765 -799 -394 -545 -283 -36 289 -131 992 772 1091 637 1008 162 294 937 895 2093 1749 1809 794 626 -176 756 947 927 1031 339 690 -120 124 11 -602 -1149 -970 -732 -1565 -1166 -1857 -1567 -925 -540 -177 263 437 382 636 -43 207 131 179 387 516 378 -10 -170 -821 -846 -282 -50 -500 -781 -881 -409 124 583 506 352 253 161 70 405 427 588 168 -114 -238 -101 -34 24 200 -168 301 470 526 174 -123 -342 -202 -98 -213 -101 90 92 -42 -23 16 -195 -164 -258 -116 -278 -439 -116 -221 -148 -321 -46 -343 -31 -67 -361 108 -224 150 -332 296 80 277 -8 -201 103 -224 34 -120 117 -223 -176 207 16 108 -383 -325 -565 -349 -219 -250 -670 -554 -302 -298 25 -252 -266 -131 -183 -96 -13 107 -52 421 346 509 308 496 81 145 459 450 1105 1002 1101 500 387 -106 452 597 638 762 262 535 -91 89 8 -383 -719 -634 -526 -1248 -1008 -1716 -1514 -931 -568 -193 293 486 418 666 -43 198 125 179 416 601 474 -13 -226 -1060 -1037 -332 -59 -616 -1005 -1176 -565 179 880 798 567 407 251 106 590 619 872 259 -181 -385 -162 -53 37 301 -246 431 679 794 278 -206 -590 -356 -178 -402 -197 178 184 -84 -47 31 -370 SS 20241119T133317.7Z 9089.564788 301 1 60.38 2 72.23 118.71 60.09 291.38 0.00 1 0.00 1 0 17 8.204e-02 1.018e-02 8.924e-02 9.565e-03 3.567551e-01 5.155470e-03 3.846314e-03 -6.000000e+00 4.990833e-02 225.84 -2.00 3.11 -2.00 319.03 0.00e+00 -1.539921e-03 1.249906e-03 5.272815e-04 -6.000000e+00 2.276423e-03 291.98 -2.00 20.00 -2.00 318.18 0.00e+00 3.230 0.000 302.00 328.00 3 6.3041e+00 1.4237e-02 3.5211e-02 -6.0000e+00 1.2294e-01 1.1597e-01 1.6524e-02 1.7312e-02 -6.0000e+00 1.3235e-01 1.4973e-02 1.1476e-02 8.1749e-03 -6.0000e+00 7.9462e-02 -1.1223e-02 6.0395e-03 3.1475e-03 -6.0000e+00 3.4658e-02 2.6570e-05 -1.1642e-03 3.1402e-04 3.4628e-05 -6.0000e+00 2.5315e-03 -6.2469e-02 6.8046e-05 12 8 8 10 0 0 99.97 19.95 0.72 -0.06247 -0.07122 32 32 1 5 0 1886.620 26.11 19.97 19.95 33.77 33.9 978.35 -34462 439 2616 2106 19165 53696 2810 9174 -3202 -7835 -9176 36836 -10346 29225 -10858 -819 -26045 -10394 11570 14409 39 3416 5999 -8559 14193 7033 6266 -3489 -619 9793 -2927 -7992 -440 3537 -68 -4255 -2603 -3309 1703 -4086 3315 -2474 -621 509 -1838 976 622 1978 -3492 -1232 1380 1573 -2024 -859 2093 193 1288 -1785 2219 2086 3025 1236 1661 2130 1337 -2507 722 -800 1116 1471 -448 2232 247 -195 812 250 -1382 -2346 -1958 1376 -215 -1594 -1893 -233 -1234 -210 -1589 824 -719 1166 -1014 1851 -874 -1411 45 -1034 1137 721 875 380 857 -1327 -825 -32 -1479 -1268 -621 123 0 2121 13 100 252 -84 88 -556 -223 -553 350 -381 621 1166 -344 1257 -412 -546 -197 51 -113 822 -526 482 -216 -1318 545 -498 754 220 493 -446 -163 -394 -1546 16 97 77 558 1099 97 334 -146 -401 -494 1362 -659 1490 -922 -71 -3070 -1119 1064 1346 4 370 652 -1135 1633 909 821 -485 -80 1142 -406 -1278 -71 576 -11 -730 -470 -697 407 -1199 1008 -847 -217 178 -661 341 217 675 -1258 -444 512 627 -895 -397 983 96 645 -922 1091 1020 1500 662 962 1308 843 -1582 420 -467 678 986 -333 1695 193 -148 571 162 -838 -1386 -1199 907 -161 -1337 -1715 -220 -1245 -223 -1793 938 -831 1288 -1079 1785 -808 -1291 42 -1081 1289 899 1155 505 1084 -1594 -941 -37 -1804 -1632 -832 171 0 3263 21 169 418 -133 131 -795 -314 -807 532 -611 1006 1864 -543 1896 -607 -772 -268 69 -163 1264 -865 814 -378 -2418 1032 -991 1526 455 1020 -912 -322 -753 SS 20241119T140457.6Z 9089.586778 316 1 0.83 2 65.78 122.72 66.84 292.37 0.00 1 0.00 1 0 17 8.865e-03 5.925e-03 3.729e-03 1.533e-03 2.699652e-01 8.237558e-04 2.934314e-03 -6.000000e+00 5.396757e-03 225.84 -2.00 3.11 -2.00 316.62 0.00e+00 4.942360e-04 1.041876e-04 1.158549e-04 -6.000000e+00 2.460523e-04 291.98 -2.00 20.00 -2.00 315.79 0.00e+00 2.420 0.000 302.00 328.00 3 8.6428e-01 2.1345e-03 2.6289e-02 -6.0000e+00 1.3295e-02 -7.2765e-04 2.3788e-03 1.2361e-02 -6.0000e+00 1.4308e-02 2.9548e-03 1.3936e-03 6.0549e-03 -6.0000e+00 8.5906e-03 -4.4799e-03 6.7442e-04 1.7300e-03 -6.0000e+00 3.7502e-03 1.5801e-02 3.3862e-05 4.8559e-05 2.3154e-05 -6.0000e+00 2.7350e-04 -6.5697e-02 1.6551e-04 12 1 1 12 1 1 -59.89 19.95 0.16 -0.06570 -0.06544 26 1966 1 5 0 30.370 26.11 19.98 19.95 34.66 33.7 978.59 -726 9 -2082 -1822 -2689 -1368 -2142 -25 -146 -1680 -911 -1017 -1156 700 -893 440 -475 1351 432 674 83 1821 1148 720 1024 868 416 -642 768 -197 1190 1608 877 -466 -2587 -2205 -2325 -738 -258 -686 -901 -949 -948 -380 -123 -448 -844 -681 -574 57 194 864 825 844 629 777 687 329 149 231 963 1502 1924 1329 509 103 -348 78 849 1110 509 506 157 405 288 67 -777 -778 -829 -600 -1454 -1413 -2152 -1517 -1015 -810 -144 242 104 29 502 583 29 350 -51 485 544 392 33 -287 -434 -880 -331 -268 -477 -782 -694 -241 228 640 537 338 215 84 216 284 515 545 333 -215 -172 -173 -206 66 235 80 277 577 641 557 -99 -203 -211 161 17 -218 48 -22 61 -239 -184 -517 -106 1 -351 -294 -402 -191 -312 -4 -26 -293 -160 -185 -232 158 -234 117 -135 395 133 214 27 589 380 250 351 309 148 -223 267 -68 420 572 338 -188 -1037 -867 -976 -330 -128 -398 -548 -612 -599 -242 -78 -286 -534 -446 -370 37 124 585 594 608 470 595 536 258 115 178 759 1195 1646 1157 451 87 -289 63 717 989 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