File name: Pandora141s1_Calakmul_20241217_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20241218T060332.8Z 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_20241217_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: 20241217 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 20241217T161455.4Z 9117.677030 391 1 13.54 2 48.46 149.05 109.54 306.35 0.00 1 0.00 1 0 17 7.527e-03 6.028e-03 8.003e-04 5.525e-04 1.683987e-01 2.993782e-04 1.878324e-03 -6.000000e+00 4.566858e-03 224.93 -2.00 3.11 -2.00 314.84 0.00e+00 2.757931e-04 2.589478e-05 4.754047e-05 -6.000000e+00 2.081122e-04 291.07 -2.00 20.00 -2.00 314.18 0.00e+00 1.505 0.000 302.00 328.00 3 2.6938e+00 7.5886e-04 1.6363e-02 -6.0000e+00 1.1231e-02 1.3709e-02 8.3724e-04 7.7072e-03 -6.0000e+00 1.2096e-02 6.0278e-03 4.8292e-04 3.7952e-03 -6.0000e+00 7.2633e-03 -5.3049e-03 2.1770e-04 1.0841e-03 -6.0000e+00 3.1740e-03 7.1563e-03 -3.0715e-04 1.7459e-05 1.6985e-05 -6.0000e+00 2.3216e-04 -6.6781e-02 1.4145e-04 12 1 1 12 1 1 99.98 19.95 0.15 -0.06678 -0.06909 138 615 1 5 0 97.330 26.11 20.03 19.95 33.94 34.1 987.99 279 118 -657 -1611 -2008 -1113 -221 1161 966 -607 -1275 -934 -414 85 111 -105 -78 236 488 587 664 647 764 1034 1306 862 197 -73 579 686 1226 1887 1114 -370 -1701 -1840 -1796 -956 -385 -731 -1111 -990 -693 -849 -485 -748 -624 -780 -582 -149 265 639 890 647 633 669 606 290 288 533 939 1341 1709 1163 516 -86 -407 -29 815 1035 507 444 414 234 123 -63 -576 -602 -536 -814 -1147 -1551 -1889 -1662 -1084 -652 -309 116 91 235 293 82 -35 323 403 523 505 449 146 -157 -520 -767 -164 -47 -572 -640 -676 -401 73 624 592 317 184 42 139 309 488 531 251 -27 -131 -126 -93 124 270 227 424 506 406 420 -9 -301 -267 145 -58 -106 136 -72 -26 -232 -246 -469 92 41 -234 -558 -649 -341 -68 381 341 -224 -474 -348 -161 36 50 -50 -38 117 246 301 345 337 400 553 719 485 111 -40 302 348 625 992 610 -207 -939 -1002 -1014 -587 -261 -541 -871 -800 -569 -702 -400 -615 -506 -621 -455 -116 208 517 742 553 550 589 537 258 254 471 840 1236 1637 1146 510 -82 -372 -26 739 989 510 460 432 241 122 -60 -516 -521 -467 -747 -1118 -1596 -2023 -1832 -1234 -768 -375 143 112 287 345 92 -38 336 423 573 583 544 183 -197 -636 -904 -189 -54 -691 -801 -868 -527 98 857 830 447 255 56 178 382 598 662 324 -36 -180 -173 -126 165 349 286 520 617 506 540 -11 -403 -362 199 -83 -154 202 -108 -39 -348 -364 -683 SS 20241217T163926.7Z 9117.694059 407 1 16.92 2 45.76 155.79 113.95 309.50 0.00 1 0.00 1 0 17 7.419e-03 5.831e-03 2.989e-04 1.883e-04 1.605466e-01 1.012574e-04 1.789054e-03 -6.000000e+00 4.500741e-03 224.93 -2.00 3.11 -2.00 315.27 0.00e+00 2.777306e-04 9.482077e-06 6.422969e-05 -6.000000e+00 2.051090e-04 291.07 -2.00 20.00 -2.00 314.56 0.00e+00 1.431 0.000 302.00 328.00 3 6.7110e-01 2.5780e-04 1.5569e-02 -6.0000e+00 1.1068e-02 -1.4982e-03 2.8547e-04 7.3463e-03 -6.0000e+00 1.1921e-02 6.2981e-03 1.6443e-04 3.6191e-03 -6.0000e+00 7.1584e-03 -5.5750e-03 7.4769e-05 1.0328e-03 -6.0000e+00 3.1276e-03 5.9285e-02 -3.0242e-04 5.9761e-06 1.5723e-05 -6.0000e+00 2.2884e-04 -6.5987e-02 1.3184e-04 10 0 0 10 0 0 99.98 19.95 0.19 -0.06599 -0.06826 2622 2622 1 5 0 6.370 26.11 19.98 19.95 34.85 34.7 987.70 272 -159 -747 -1646 -1899 -1279 -385 931 997 -408 -1178 -976 -324 78 235 -49 -106 198 534 551 594 673 773 956 1035 823 197 -90 414 822 1172 1818 1217 -424 -1662 -1947 -1806 -796 -321 -819 -1066 -948 -728 -698 -545 -484 -752 -739 -509 -102 238 615 876 652 505 674 666 287 286 537 1049 1388 1660 1156 509 -116 -360 18 797 984 518 366 395 230 154 -127 -570 -608 -640 -699 -1161 -1615 -1889 -1679 -1133 -639 -291 122 126 244 242 115 -39 331 371 465 502 466 152 -141 -519 -791 -263 -74 -526 -628 -693 -304 169 635 622 447 237 47 106 276 353 491 342 -10 -68 -139 -104 49 187 134 325 454 430 344 -42 -280 -248 64 -69 -22 110 24 -17 -182 -209 -468 79 -50 -239 -503 -527 -329 -100 261 308 -134 -388 -321 -113 27 91 -21 -46 88 243 257 281 318 367 468 529 434 104 -45 193 364 521 844 598 -215 -821 -941 -922 -461 -201 -592 -786 -733 -577 -557 -433 -381 -579 -549 -393 -78 184 465 694 538 429 581 581 251 247 463 922 1286 1528 1118 492 -105 -323 16 703 952 513 380 414 236 148 -120 -488 -526 -520 -617 -1141 -1625 -2036 -1905 -1275 -766 -367 149 154 309 287 132 -42 332 380 513 568 575 198 -184 -646 -920 -313 -84 -639 -813 -885 -403 233 913 875 633 343 64 140 341 430 618 459 -13 -95 -196 -143 65 249 170 393 579 533 451 -58 -393 -333 89 -100 -33 164 36 -26 -278 -327 -714 SS 20241217T163943.8Z 9117.694257 407 2 16.82 2 45.74 155.88 114.00 309.53 0.00 1 0.00 1 0 17 3.993e-02 1.667e-02 4.633e-02 1.905e-02 1.795099e-01 1.013548e-02 2.055243e-03 -6.000000e+00 2.422831e-02 224.93 -2.00 3.11 -2.00 316.82 0.00e+00 -3.003501e-04 1.315209e-03 3.641346e-04 -6.000000e+00 1.104047e-03 291.07 -2.00 20.00 -2.00 315.98 0.00e+00 1.431 0.000 302.00 328.00 3 6.1500e+00 2.6326e-02 1.6048e-02 -6.0000e+00 5.9582e-02 -2.9427e-02 2.9387e-02 8.4485e-03 -6.0000e+00 6.4170e-02 5.8404e-02 1.7178e-02 4.0529e-03 -6.0000e+00 3.8532e-02 -2.5534e-02 8.2968e-03 1.4181e-03 -6.0000e+00 1.6840e-02 2.3516e-04 -6.6378e-04 6.2098e-04 1.9433e-05 -6.0000e+00 1.2315e-03 -6.7485e-02 1.3953e-04 12 8 8 10 0 0 92.92 19.95 0.30 -0.06748 -0.07247 2622 2622 1 5 0 6.370 26.11 19.98 19.95 34.89 34.7 987.70 -1799 3828 3347 -4640 15752 4131 8817 2306 18607 -9712 12219 12484 8472 -1845 -6110 2890 -513 -4881 -3658 594 -7204 -6705 5303 2918 1894 4485 -4184 -4508 8627 11268 -6054 4848 -2655 3384 -138 194 -9031 -2770 -3581 -1441 -1959 -3290 -548 -3134 1460 700 -104 -3334 1554 -2563 720 4393 3544 3019 894 3150 -1505 -877 -2083 391 3366 799 1267 1044 262 -1316 113 488 61 831 1528 2904 -798 2696 1506 -3 222 -323 -1483 -1022 -1611 -4314 -2152 -2644 853 467 114 1587 -1423 935 -539 -1399 -2757 -1385 1888 1558 787 322 2151 -1465 -518 -314 1641 -51 301 -2030 -2103 -740 941 -219 3475 854 437 973 -1056 -1695 -513 -290 1621 -410 -1397 -373 975 1168 812 943 -602 -2059 -583 1073 -1059 -720 -950 -1081 308 361 1284 -1019 1068 339 936 -1194 -295 646 581 -830 2209 606 1273 383 2951 -2043 2160 2224 1654 -431 -1627 766 -146 -1477 -1124 181 -2400 -2238 1617 941 645 1540 -1547 -1608 2613 3226 -2030 1557 -956 1181 -49 67 -3529 -1159 -1745 -783 -1163 -2077 -347 -2053 919 441 -65 -2083 909 -1546 433 2688 2294 2040 633 2232 -1127 -654 -1558 286 2454 627 1054 907 229 -1109 88 364 48 697 1376 2706 -777 2491 1336 -3 169 -233 -1094 -810 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