File name: Pandora25s1_HoustonTX_20220902_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T154746.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20220902_L1_smca1c6d20220503p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20220902 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: Update session 4 for SO2 First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.1116 305.2524 305.3931 305.5338 305.6745 305.8152 305.9558 306.0965 306.2371 306.3777 306.5183 306.6589 306.7995 306.9401 307.0806 307.2212 307.3617 307.5022 307.6427 307.7832 307.9236 308.0641 308.2045 308.3449 308.4853 308.6257 308.7661 308.9065 309.0468 309.1872 309.3275 309.4678 309.6081 309.7484 309.8886 310.0289 310.1691 310.3093 310.4495 310.5897 310.7299 310.8701 311.0102 311.1504 311.2905 311.4306 311.5707 311.7108 311.8509 311.9909 312.1310 312.2710 312.4110 312.5510 312.6910 312.8310 312.9709 313.1109 313.2508 313.3907 313.5306 313.6705 313.8104 313.9503 314.0901 314.2300 314.3698 314.5096 314.6494 314.7892 314.9290 315.0687 315.2085 315.3482 315.4879 315.6276 315.7673 315.9070 316.0466 316.1863 316.3259 316.4656 316.6052 316.7448 316.8843 317.0239 317.1635 317.3030 317.4425 317.5821 317.7216 317.8611 318.0005 318.1400 318.2794 318.4189 318.5583 318.6977 318.8371 318.9765 319.1159 319.2552 319.3946 319.5339 319.6732 319.8125 319.9518 320.0911 320.2304 320.3696 320.5089 320.6481 320.7873 320.9265 321.0657 321.2049 321.3441 321.4832 321.6223 321.7615 321.9006 322.0397 322.1788 322.3178 322.4569 322.5960 322.7350 322.8740 323.0130 323.1520 323.2910 323.4300 323.5689 323.7079 323.8468 323.9857 324.1246 324.2635 324.4024 324.5413 324.6801 324.8190 324.9578 --------------------------------------------------------------------------------------- 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 20220902T125951.0Z 8280.541562 62 1 34.75 2 77.75 87.94 152.07 76.10 0.00 1 0.00 1 0 25 3.321e-01 8.992e-03 1.096e-01 3.191e-03 5.472219e-01 1.693503e-03 5.817798e-03 -6.000000e+00 1.933543e-01 228.92 -2.00 3.24 -2.00 320.41 0.00e+00 1.930124e-03 6.593729e-04 2.193533e-04 -6.000000e+00 9.234186e-03 294.02 -2.00 20.00 -2.00 319.60 0.00e+00 4.573 0.001 302.00 328.00 3 2.9679e+00 5.3351e-03 5.2534e-02 -6.0000e+00 4.8163e-01 -2.5454e-02 6.8298e-03 2.6724e-02 -6.0000e+00 5.2301e-01 -9.3508e-03 5.9849e-03 1.3313e-02 -6.0000e+00 3.1099e-01 -2.3038e-03 3.0064e-03 4.7573e-03 -6.0000e+00 1.3300e-01 1.6553e-04 -6.1717e-04 9.2221e-05 4.7418e-05 -6.0000e+00 9.3533e-03 -1.9348e-03 5.9582e-05 12 9 1 12 1 1 98.41 24.57 0.33 -0.00193 -0.00657 34 11 1 5 0 987.660 27.05 20.00 24.57 32.65 27.0 992.47 -140841 900000 -62181 900000 -112400 -45698 900000 -66201 900000 -124850 -83169 256439 -62505 -18449 -25594 900000 35607 29762 -6761 17287 15090 -10186 -16043 803 -4418 6131 -21100 -17798 -8293 -15949 38655 14925 13598 -4375 -17554 11887 8319 36325 3254 -2963 -7018 3081 8285 998 5657 2561 -4248 452 13634 -1990 4878 -2450 1009 1909 3472 1693 1674 -3564 1501 -993 -1132 -238 -522 2280 -1400 -248 -1327 496 1412 615 620 1935 -361 -170 3177 728 -2848 -1377 104 -589 -665 -669 -2445 1641 -862 -1112 264 -303 444 1324 742 1185 1097 -548 48 181 -56 -75 283 -723 280 -1186 -914 -1348 470 -1013 -628 -1000 700 -832 225 368 120 178 103 505 2 81 -24 -249 -182 381 -19 240 -5 612 261 938 245 605 186 -255 -342 909 -262 -193 -96 194 -390 -348 126 -394 120 -2821 900000 -707 900000 -1823 -403 900000 -904 900000 -3525 -1673 797 -1471 -357 -643 900000 645 622 -212 458 417 -360 -638 30 -185 244 -1088 -862 -367 -822 1400 779 810 -318 -1384 730 594 2389 352 -396 -1072 456 1221 160 887 421 -757 79 2192 -393 997 -590 255 513 965 496 502 -1117 441 -298 -356 -81 -200 928 -600 -102 -541 205 639 316 343 1093 -205 -92 1554 333 -1272 -617 51 -332 -424 -473 -1872 1275 -724 -988 241 -285 413 1185 630 950 851 -441 42 176 -60 -89 353 -900 329 -1311 -960 -1450 528 -1201 -774 -1297 954 -1233 352 591 193 276 152 726 2 122 -38 -404 -296 605 -30 365 -7 874 366 1344 380 1009 329 -469 -649 1776 -538 -411 -207 425 -856 -747 260 -792 236 SS 20220902T130533.1Z 8280.545522 65 1 49.33 2 76.51 88.64 150.93 77.31 0.00 1 0.00 1 0 25 4.479e-01 3.819e-02 8.392e-02 2.616e-03 4.776567e-01 1.354252e-03 7.224781e-03 -6.000000e+00 2.597651e-01 228.92 -2.00 3.24 -2.00 320.11 0.00e+00 2.085986e-02 4.687377e-04 5.805305e-03 -6.000000e+00 1.219464e-02 294.02 -2.00 20.00 -2.00 319.28 0.00e+00 4.182 0.001 302.00 328.00 3 3.2732e+00 4.1394e-03 5.0372e-02 -6.0000e+00 6.4676e-01 2.3478e-01 4.9340e-03 2.6844e-02 -6.0000e+00 7.0179e-01 -4.5986e-01 3.3958e-03 1.9020e-02 -6.0000e+00 4.1694e-01 2.2371e-01 1.7609e-03 1.1395e-02 -6.0000e+00 1.7828e-01 1.7599e-04 -9.1048e-04 7.5067e-05 2.2240e-04 -6.0000e+00 1.2417e-02 -2.0846e-03 4.9657e-05 12 9 8 11 8 0 86.66 24.56 0.49 -0.00208 -0.00893 57 12 1 5 0 865.340 27.05 20.00 24.56 32.90 27.0 994.04 -165683 900000 129119 273829 81357 88784 900000 41495 900000 -16356 22705 95463 82855 73679 92231 74359 81843 106158 85112 112100 96692 78641 40884 62612 37709 40164 15419 43171 38053 42548 67132 58957 58885 39503 33706 44195 41448 53059 27897 16552 14052 19094 21503 17464 23923 25419 21247 21394 26556 17480 19997 14880 12346 15075 9642 4938 2917 -3487 899 1339 4400 5101 5812 7410 6817 5561 5195 2070 2850 1321 -343 -937 -2844 -3647 -1500 -1669 -6972 -3674 -3437 -835 -2513 -3032 -4956 -2213 -4472 -5292 -3522 -3637 -2674 -1349 -1032 -2191 -2706 -4075 -3487 -2612 -1934 -1292 -224 -829 -4 -1550 -1700 -2279 -976 -1599 -856 -921 1034 467 495 802 504 -62 -233 624 555 1077 1397 1627 1631 2390 2812 2108 2183 2409 1791 2259 1539 1868 1444 870 49 881 -374 -565 -662 -398 -1390 -1133 -948 -1721 -1851 -30460 900000 1740 836 1382 1287 900000 906 900000 -593 564 1360 1699 2100 2706 2942 3289 3640 3694 3862 3760 3440 2450 2974 2197 2271 1084 2315 2199 2625 3872 4212 4652 3761 3153 3692 3817 4953 3752 2745 2540 3454 4001 3493 4663 5039 4465 4570 5509 4094 4919 4124 3699 4595 3121 1667 996 -1240 303 458 1559 1986 2504 3413 3202 2526 2292 947 1402 733 -206 -579 -1756 -2159 -809 -824 -3409 -1769 -1827 -498 -1710 -2276 -4003 -1824 -3960 -4968 -3393 -3595 -2626 -1273 -917 -1848 -2196 -3394 -3144 -2612 -2147 -1570 -285 -1051 -4 -1749 -1827 -2511 -1129 -1943 -1081 -1223 1438 700 786 1300 810 -96 -346 896 804 1617 2196 2648 2663 3818 4383 3217 3227 3452 2513 3236 2379 3091 2525 1578 92 1695 -756 -1181 -1405 -855 -3004 -2393 -1934 -3415 -3606 SS 20220902T131134.5Z 8280.549705 68 1 49.41 2 75.21 89.39 149.72 78.52 0.00 1 0.00 1 0 17 4.862e-01 1.049e-02 1.067e-01 2.346e-03 4.666648e-01 1.201937e-03 5.035366e-03 -6.000000e+00 2.790867e-01 228.92 -2.00 3.24 -2.00 319.76 0.00e+00 1.655750e-03 3.737897e-04 5.359480e-04 -6.000000e+00 1.288216e-02 294.02 -2.00 20.00 -2.00 318.88 0.00e+00 3.836 0.001 302.00 328.00 3 3.5173e+00 3.5347e-03 4.4257e-02 -6.0000e+00 6.9251e-01 -3.2870e-03 4.2741e-03 2.2595e-02 -6.0000e+00 7.5015e-01 -3.1153e-02 3.3083e-03 1.1201e-02 -6.0000e+00 4.4954e-01 9.5940e-03 1.7173e-03 3.4067e-03 -6.0000e+00 1.9248e-01 2.0771e-04 -3.0640e-04 6.7576e-05 3.8072e-05 -6.0000e+00 1.3245e-02 -2.5509e-03 8.5376e-05 12 8 8 10 0 0 28.50 24.56 0.24 -0.00255 -0.00485 53 11 1 5 0 932.140 27.05 19.99 24.56 33.15 26.9 994.99 -142742 42888 10067 36442 -54582 -19290 496415 -49839 181724 -71985 -45902 21901 -27128 865 -15420 44514 -529 16726 -3511 16305 859 4087 -10047 8516 -1282 2586 -4885 -3256 -644 -2325 17942 8979 11508 -4214 -6076 7578 4111 11799 1053 -1464 -2238 3329 2430 -266 4241 3352 -1624 611 4629 -135 3102 -1122 439 2323 2053 600 2119 -2716 2309 -41 259 968 302 1297 464 199 248 -90 1779 1388 528 873 -561 347 1343 729 -3618 -1127 -1259 225 -1432 -2046 -2118 865 -744 -1515 114 -322 243 781 764 278 558 -450 -302 637 -289 221 79 -435 -159 -1458 -913 -973 77 -797 -1122 -829 660 -107 339 490 415 24 15 317 133 230 14 -37 -467 286 513 261 395 1137 249 730 335 550 314 0 -383 465 -189 -1 -45 56 -518 -283 15 -481 -123 -7831 480 157 421 -1339 -346 1136 -1466 699 -3020 -1561 448 -1040 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