File name: Pandora29s1_Fajardo_20231230_L2Fit_fout2c2d20220426p1-8.txt File generation date: 20260409T145922.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 29 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora29_OF_v2d20211130.txt Instrument calibration file used: Pandora29s1_CF_v2d20220426.txt Level 1 file used: Pandora29s1_Fajardo_20231230_L1_smca1c2d20220426p1-8.txt Full location name: Cape San Juan Light, Fajardo (Puerto Rico) Short location name: Fajardo Country of location: Puerto Rico Location latitude [deg]: 18.3797 Location longitude [deg]: -65.6184 Location altitude [m]: 66 Local noon date: 20231230 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 243 385 Nominal wavelengths inside fitting window [nm]: 305.0193 305.1603 305.3013 305.4423 305.5833 305.7243 305.8652 306.0062 306.1471 306.2880 306.4289 306.5699 306.7107 306.8516 306.9925 307.1334 307.2742 307.4150 307.5559 307.6967 307.8375 307.9783 308.1190 308.2598 308.4006 308.5413 308.6820 308.8228 308.9635 309.1042 309.2449 309.3855 309.5262 309.6668 309.8075 309.9481 310.0887 310.2293 310.3699 310.5105 310.6511 310.7917 310.9322 311.0727 311.2133 311.3538 311.4943 311.6348 311.7753 311.9157 312.0562 312.1966 312.3371 312.4775 312.6179 312.7583 312.8987 313.0391 313.1794 313.3198 313.4601 313.6005 313.7408 313.8811 314.0214 314.1617 314.3019 314.4422 314.5825 314.7227 314.8629 315.0031 315.1433 315.2835 315.4237 315.5639 315.7040 315.8442 315.9843 316.1244 316.2646 316.4047 316.5447 316.6848 316.8249 316.9649 317.1050 317.2450 317.3850 317.5250 317.6650 317.8050 317.9450 318.0849 318.2249 318.3648 318.5048 318.6447 318.7846 318.9245 319.0643 319.2042 319.3441 319.4839 319.6237 319.7636 319.9034 320.0432 320.1829 320.3227 320.4625 320.6022 320.7420 320.8817 321.0214 321.1611 321.3008 321.4405 321.5802 321.7198 321.8595 321.9991 322.1387 322.2783 322.4179 322.5575 322.6971 322.8367 322.9762 323.1157 323.2553 323.3948 323.5343 323.6738 323.8133 323.9527 324.0922 324.2316 324.3711 324.5105 324.6499 324.7893 324.9287 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20231230T113537.5Z 8764.483072 244 1 51.91 2 81.89 117.78 61.98 282.88 0.00 1 0.00 1 0 25 2.834e-01 1.443e-02 1.228e-01 2.029e-03 6.135304e-01 1.046612e-03 6.517977e-03 -6.000000e+00 1.578866e-01 224.87 -2.00 3.11 -2.00 320.97 0.00e+00 -5.277438e-03 4.999201e-04 2.468189e-03 -6.000000e+00 7.313896e-03 292.01 -2.00 20.00 -2.00 320.27 0.00e+00 6.633 0.001 302.00 328.00 3 5.6802e-01 3.6528e-03 7.1685e-02 -6.0000e+00 3.8865e-01 1.2487e-02 4.9362e-03 3.1828e-02 -6.0000e+00 4.2204e-01 -1.1919e-01 4.7497e-03 1.7013e-02 -6.0000e+00 2.5343e-01 5.5826e-02 2.3081e-03 5.4511e-03 -6.0000e+00 1.1008e-01 2.7547e-04 -1.3322e-04 5.5629e-05 8.1132e-05 -6.0000e+00 7.2525e-03 -1.6302e-03 3.4680e-05 12 8 8 10 0 0 -4.84 20.22 0.46 -0.00163 -0.00263 172 27 1 5 0 301.730 23.72 20.00 20.22 29.65 26.1 995.54 -97938 -95836 -114093 -102421 -101927 -88205 16462 -54508 -71415 -130878 -77418 9036 36153 -35655 -85932 34874 -35025 8597 -20181 13328 9975 -30347 -30617 3617 17401 16960 4731 4465 -1995 -13848 13187 -1839 -4532 1467 -1349 3372 -15341 -6292 4264 4132 6375 6893 3903 9815 5505 3598 6281 2492 7701 -3166 3917 4117 935 -247 3224 4256 5270 2705 3629 6786 3431 1510 3686 299 891 -2659 -539 -1648 100 -808 -1246 -1432 -824 -1103 -33 205 3 -2029 -2228 -3422 -3529 -3962 -4766 -3200 -2424 -1607 -931 -1069 -538 -357 220 756 3144 4278 4660 4842 5098 4575 3803 2155 1465 48 -349 -1851 -3576 -4337 -2963 -1286 334 39 295 -497 -188 -262 -28 172 507 33 -591 -996 -1018 153 994 611 887 548 1014 2373 907 -156 -408 -452 -40 -136 -698 -546 272 77 -107 -676 -504 379 1139 -581 -664 -1038 -831 -746 -541 39 -313 -579 -2201 -812 43 157 -395 -1938 283 -644 112 -383 193 156 -715 -757 72 344 369 122 111 -50 -392 326 -63 -185 63 -58 133 -798 -356 273 329 579 678 417 1012 591 399 686 288 881 -427 546 650 169 -50 677 937 1211 648 839 1474 777 376 1018 97 282 -852 -181 -572 34 -322 -564 -691 -398 -512 -14 78 1 -714 -855 -1574 -1914 -2492 -3372 -2176 -1756 -1246 -760 -909 -460 -296 170 542 2097 2846 3414 4095 4585 4763 4113 2408 1562 51 -336 -1799 -3852 -5025 -3562 -1628 453 56 464 -788 -299 -435 -44 254 748 51 -984 -1641 -1688 260 1622 972 1353 812 1434 3379 1474 -270 -782 -869 -81 -290 -1514 -1257 638 185 -259 -1593 -1120 838 2405 SS 20231230T115110.0Z 8764.493866 249 1 51.90 2 78.65 119.30 65.50 283.60 0.00 1 0.00 1 0 25 6.889e-02 1.645e-02 1.269e-02 7.030e-04 4.650737e-01 3.511125e-04 5.132504e-03 -6.000000e+00 3.837775e-02 224.87 -2.00 3.11 -2.00 319.64 0.00e+00 -2.056709e-03 1.065652e-04 1.753956e-03 -6.000000e+00 1.777765e-03 292.01 -2.00 20.00 -2.00 318.79 0.00e+00 4.908 0.000 302.00 328.00 3 4.7453e-01 1.0238e-03 5.3216e-02 -6.0000e+00 9.4469e-02 -6.3263e-02 1.2319e-03 2.3934e-02 -6.0000e+00 1.0258e-01 -6.0840e-03 9.9234e-04 1.1283e-02 -6.0000e+00 6.1602e-02 5.4210e-03 5.2244e-04 3.0175e-03 -6.0000e+00 2.6757e-02 1.7478e-03 1.7090e-04 1.9506e-05 3.9008e-05 -6.0000e+00 1.7628e-03 -1.9530e-03 3.6567e-05 12 8 8 10 0 0 -16.16 20.21 0.44 -0.00195 -0.00067 472 74 1 5 0 109.930 23.72 20.00 20.21 30.88 26.3 1003.60 -28057 -26119 -21726 -23868 -22640 -26479 -24181 -20547 -18284 -19998 -16815 -4548 -5875 -2539 -10239 98 -1373 1094 857 1816 -207 -308 564 3229 5782 4619 4817 3001 1046 -1757 3214 1069 363 -1047 -4691 -1331 -1918 775 1611 1861 3356 2192 2950 2313 2717 1865 1540 599 253 -177 1252 586 -73 224 439 915 801 34 1061 1196 1726 1909 1521 1303 -903 -1889 -1244 -1057 23 -1003 -1247 -1169 -1530 -862 -783 -672 -468 -1237 -1048 -2305 -2700 -2900 -3963 -3106 -2128 -1538 -1050 -1259 -491 -365 296 1680 3307 5076 5609 5601 5529 5248 3984 2680 1838 709 40 -1093 -3454 -4113 -3095 -1306 443 326 -145 -614 -661 -828 -534 -119 152 -242 -466 -1030 -920 -170 798 539 642 219 1245 2402 1108 -97 -645 -537 -134 -259 -579 -710 -370 76 -66 -501 -219 526 1539 -404 -433 -374 -417 -352 -407 -391 -372 -379 -472 -399 -100 -153 -78 -409 4 -65 55 46 103 -13 -19 35 216 417 363 392 240 80 -138 266 104 41 -130 -585 -153 -241 112 285 365 744 529 742 600 703 493 411 162 70 -51 384 202 -25 84 175 378 345 15 452 498 727 866 775 685 -512 -1038 -645 -591 13 -642 -835 -829 -1100 -593 -541 -417 -263 -678 -609 -1577 -1998 -2446 -3472 -2850 -2072 -1507 -1087 -1358 -531 -385 289 1598 2895 4296 5104 5429 5749 5880 4964 3411 2229 794 44 -1215 -4056 -5187 -4054 -1785 605 489 -228 -1017 -1088 -1304 -823 -172 218 -364 -713 -1689 -1532 -275 1241 858 974 321 1822 3502 1709 -159 -1102 -966 -248 -481 -1108 -1444 -771 154 -137 -1053 -438 1038 2906 SS 20231230T115703.1Z 8764.497952 252 1 51.91 2 77.44 119.91 66.82 283.88 0.00 1 0.00 1 0 25 4.824e-02 1.692e-02 6.567e-03 5.407e-04 4.244195e-01 2.682019e-04 4.702465e-03 -6.000000e+00 2.687643e-02 224.87 -2.00 3.11 -2.00 319.18 0.00e+00 -1.368445e-03 7.012103e-05 1.426519e-03 -6.000000e+00 1.244989e-03 292.01 -2.00 20.00 -2.00 318.31 0.00e+00 4.469 0.000 302.00 328.00 3 4.4263e-01 7.5849e-04 4.8369e-02 -6.0000e+00 6.6158e-02 -6.6285e-02 8.9325e-04 2.1452e-02 -6.0000e+00 7.1841e-02 6.7326e-03 6.6687e-04 1.0022e-02 -6.0000e+00 4.3140e-02 -1.6585e-03 3.5398e-04 2.7132e-03 -6.0000e+00 1.8739e-02 2.8376e-03 1.8445e-04 1.4991e-05 3.2088e-05 -6.0000e+00 1.2345e-03 -2.0591e-03 3.2690e-05 12 8 8 10 0 0 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