File name: Pandora141s1_Calakmul_20250221_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250222T061758.5Z 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 v1.8.74 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20250221_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: 20250221 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 20250221T133849.5Z 9183.568629 267 1 15.28 2 73.11 107.46 49.36 199.86 0.00 1 0.00 1 0 25 1.051e-01 9.449e-03 9.331e-02 8.355e-03 3.787475e-01 4.480885e-03 4.083463e-03 -6.000000e+00 6.371148e-02 225.62 -2.00 3.11 -2.00 319.15 0.00e+00 1.201752e-03 1.144467e-03 1.286224e-04 -6.000000e+00 2.901158e-03 290.76 -2.00 20.00 -2.00 318.33 0.00e+00 3.389 0.000 302.00 328.00 3 5.2426e+00 1.2455e-02 3.6955e-02 -6.0000e+00 1.5693e-01 6.6366e-02 1.4532e-02 1.7668e-02 -6.0000e+00 1.6919e-01 1.6910e-02 1.0448e-02 8.7327e-03 -6.0000e+00 1.0150e-01 -1.8167e-02 5.5041e-03 2.6579e-03 -6.0000e+00 4.4076e-02 6.5658e-05 -1.7138e-03 2.7090e-04 3.4011e-05 -6.0000e+00 3.2476e-03 -4.7416e-02 -2.4180e-04 12 9 9 12 9 1 99.99 19.90 0.30 -0.04742 -0.06029 12 51 1 5 0 1174.560 26.11 19.97 19.90 30.18 38.8 988.73 -16897 -6986 -6381 66884 2944 -14769 -50975 7448 -2847 57979 -25733 18206 21232 -3712 -4493 -4365 23930 -10895 18068 -6904 4215 -7301 -14159 -3285 7728 9490 -5558 7488 -11781 15491 -11346 -527 4441 626 1486 -5685 1406 294 2471 -3502 52 -1979 140 518 -983 501 1438 1593 -2034 -2946 1164 -265 2939 98 3722 254 4648 -445 -686 -2082 2202 739 2123 1626 355 3179 203 113 -461 -859 849 -1131 661 615 20 -1211 -666 -3943 -341 -1056 -3362 -371 -1220 -323 -1054 -435 -833 639 274 731 1214 1182 191 -299 -119 431 906 298 -1043 72 -772 818 -1038 517 -1685 -553 -458 17 709 874 1255 94 530 654 -115 -1208 -1016 -108 29 199 166 -435 -324 763 -610 -322 -81 2 844 304 -9 -266 -313 -79 463 49 688 -57 65 549 -1153 -271 -527 -222 -210 1094 81 -466 -2377 227 -106 1307 -1296 656 852 -221 -313 -341 1559 -1042 1393 -700 397 -775 -1649 -367 830 1043 -704 817 -1499 1555 -1580 -74 649 98 227 -932 234 57 560 -964 15 -628 45 170 -330 167 474 524 -699 -1053 426 -106 1218 44 1681 122 2183 -219 -334 -1027 1081 393 1212 989 221 1869 118 66 -288 -592 622 -875 503 453 14 -784 -400 -2393 -212 -735 -2659 -313 -1107 -306 -1061 -459 -922 716 307 794 1244 1138 176 -276 -115 456 1049 375 -1394 96 -982 963 -1197 597 -2082 -711 -613 23 1035 1349 2020 155 859 1017 -170 -1746 -1466 -159 45 318 269 -701 -511 1159 -906 -460 -113 2 1252 483 -16 -458 -555 -145 881 96 1386 -118 133 1104 -2284 -517 SS 20250221T134454.5Z 9183.572853 271 1 39.82 2 71.74 108.08 49.87 201.46 0.00 1 0.00 1 0 25 3.393e-02 5.479e-03 2.118e-02 2.381e-03 3.567866e-01 1.274811e-03 3.842215e-03 -6.000000e+00 2.058080e-02 225.62 -2.00 3.11 -2.00 319.03 0.00e+00 6.644756e-04 3.113085e-04 3.893859e-04 -6.000000e+00 9.368043e-04 290.76 -2.00 20.00 -2.00 318.20 0.00e+00 3.149 0.000 302.00 328.00 3 4.0816e+00 3.5215e-03 3.4448e-02 -6.0000e+00 5.0692e-02 1.0275e-02 4.0873e-03 1.6638e-02 -6.0000e+00 5.4637e-02 2.4977e-02 2.8794e-03 8.2133e-03 -6.0000e+00 3.2778e-02 -1.6714e-02 1.5148e-03 2.3468e-03 -6.0000e+00 1.4245e-02 2.7778e-04 -7.8373e-04 7.7688e-05 3.0545e-05 -6.0000e+00 1.0477e-03 -4.9229e-02 -9.7324e-05 12 1 1 12 9 1 100.00 19.90 0.15 -0.04923 -0.05512 154 234 1 5 0 256.830 26.11 20.02 19.90 30.71 39.0 988.76 -13945 1698 -6265 3575 -554 -21033 10349 -11749 15753 -5140 6267 -1991 350 -4027 -6200 5057 -5582 4769 -3784 4929 -1479 389 1676 -1990 971 -1307 1935 -3083 -715 1688 983 794 799 2520 -2998 794 -4432 1460 -791 -170 46 -1766 -857 -1457 40 -1174 374 -1731 -645 -711 -438 1362 -166 1271 -418 1193 -573 196 35 -74 1438 1177 2710 1041 1501 -165 -285 738 814 1364 84 1117 143 681 -379 603 -735 -7 -168 -950 -751 -1623 -1733 -1672 -785 -408 -378 483 -56 353 -28 696 -52 489 355 656 553 356 -73 -476 -363 -1123 305 -249 -633 -861 -994 -363 197 887 303 452 84 200 83 394 684 179 34 -486 -88 -167 -88 186 48 247 224 689 149 238 -201 -356 -225 146 55 -252 205 -137 33 -209 9 -22 -491 58 -238 120 -18 -808 317 -491 568 -237 270 -98 19 -269 -488 401 -526 433 -391 490 -161 42 184 -241 122 -174 251 -405 -89 208 131 118 129 413 -508 130 -825 299 -195 -48 14 -590 -295 -512 14 -417 131 -614 -228 -259 -169 554 -73 583 -202 586 -291 99 17 -37 735 643 1584 653 949 -102 -169 434 511 937 63 861 111 510 -270 393 -451 -4 -106 -669 -587 -1396 -1592 -1615 -795 -435 -420 547 -64 388 -29 680 -48 452 346 695 643 448 -97 -630 -459 -1345 349 -291 -780 -1115 -1343 -509 289 1369 490 743 137 311 122 560 969 262 52 -778 -143 -268 -138 284 70 353 312 971 222 376 -334 -610 -395 265 104 -495 410 -278 67 -419 18 -42 SS 20250221T135439.7Z 9183.579626 277 1 4.84 2 69.54 109.12 50.75 203.96 0.00 1 0.00 1 0 17 2.861e-02 8.416e-03 3.476e-02 7.168e-03 3.218324e-01 3.816307e-03 3.457846e-03 -6.000000e+00 1.736457e-02 225.62 -2.00 3.11 -2.00 317.98 0.00e+00 1.155389e-03 6.914007e-04 3.742766e-04 -6.000000e+00 7.898766e-04 290.76 -2.00 20.00 -2.00 317.14 0.00e+00 2.832 0.000 302.00 328.00 3 4.7241e+00 1.0158e-02 3.0923e-02 -6.0000e+00 4.2771e-02 3.2728e-02 1.1506e-02 1.4768e-02 -6.0000e+00 4.6088e-02 9.3582e-03 7.3068e-03 7.3119e-03 -6.0000e+00 2.7650e-02 -1.0700e-02 3.7718e-03 2.1929e-03 -6.0000e+00 1.2026e-02 2.0461e-04 2.4626e-04 2.2888e-04 2.6844e-05 -6.0000e+00 8.8301e-04 -5.1441e-02 2.2173e-05 12 9 1 12 9 1 99.96 19.90 0.18 -0.05144 -0.04959 3 50 1 5 0 1207.170 26.11 20.02 19.90 31.58 38.8 988.91 -9109 -2007 158 -3073 -10994 -16315 -10550 9322 -1826 -7642 -2049 7366 5602 -2017 -4546 283 -4269 2658 981 3941 2076 2187 -1993 -337 1394 -1803 1130 -5728 -3292 2748 697 2825 805 -1088 -1647 -1133 943 2631 1611 -3430 -908 -790 -443 -396 -1075 542 324 -1947 -463 -2288 388 2679 1449 1621 988 1266 134 425 1981 785 1383 -229 1402 926 606 728 65 379 1016 570 269 1452 532 -876 -903 -972 -227 -1586 -1331 -1263 -2896 -2291 -2036 -1019 -1623 755 -255 553 523 434 658 1023 -1433 839 669 2047 200 890 -4 -280 -604 -2095 37 -906 -543 -552 -1093 169 -153 479 319 1028 656 -688 369 393 548 449 346 -23 26 363 187 277 -437 -332 1106 -10 1055 -333 -795 -94 5 -300 -5 -205 -524 -134 84 270 -248 218 -594 -135 11 -208 -747 -1126 -726 593 -142 -661 -173 600 522 -234 -618 41 -685 421 165 669 367 390 -378 -66 285 -392 239 -1246 -678 538 148 642 200 -283 -421 -288 253 799 573 -1438 -405 -369 -213 -193 -529 264 157 -955 -224 -1148 199 1435 827 964 609 796 86 272 1244 498 898 -159 1026 711 469 543 47 271 762 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