File name: Pandora257s1_AustinTX_20251006_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20251007T062609.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Paul Walter Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 257 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20251006_L1_smca1c2d20230110p1-8.txt Full location name: St. Edward's University Short location name: AustinTX Country of location: United States Location latitude [deg]: 30.2285 Location longitude [deg]: -97.7544 Location altitude [m]: 205 Local noon date: 20251006 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: OOB session based on clearance session 1 First and last pixel inside fitting window: 228 370 Nominal wavelengths inside fitting window [nm]: 305.0779 305.2183 305.3587 305.4991 305.6395 305.7799 305.9203 306.0607 306.2010 306.3413 306.4817 306.6220 306.7623 306.9026 307.0429 307.1832 307.3234 307.4637 307.6039 307.7442 307.8844 308.0246 308.1648 308.3050 308.4452 308.5854 308.7255 308.8657 309.0058 309.1459 309.2860 309.4261 309.5662 309.7063 309.8464 309.9865 310.1265 310.2665 310.4066 310.5466 310.6866 310.8266 310.9666 311.1065 311.2465 311.3865 311.5264 311.6663 311.8062 311.9461 312.0860 312.2259 312.3658 312.5057 312.6455 312.7854 312.9252 313.0650 313.2048 313.3446 313.4844 313.6242 313.7639 313.9037 314.0434 314.1832 314.3229 314.4626 314.6023 314.7420 314.8816 315.0213 315.1610 315.3006 315.4402 315.5799 315.7195 315.8591 315.9986 316.1382 316.2778 316.4173 316.5569 316.6964 316.8359 316.9754 317.1149 317.2544 317.3939 317.5334 317.6728 317.8123 317.9517 318.0911 318.2305 318.3699 318.5093 318.6487 318.7880 318.9274 319.0667 319.2061 319.3454 319.4847 319.6240 319.7633 319.9025 320.0418 320.1810 320.3203 320.4595 320.5987 320.7379 320.8771 321.0163 321.1555 321.2946 321.4338 321.5729 321.7121 321.8512 321.9903 322.1294 322.2685 322.4075 322.5466 322.6856 322.8247 322.9637 323.1027 323.2417 323.3807 323.5197 323.6587 323.7976 323.9366 324.0755 324.2144 324.3533 324.4922 324.6311 324.7700 324.9089 --------------------------------------------------------------------------------------- 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 20251006T125725.9Z 9410.539883 237 1 55.34 2 84.47 99.48 104.74 282.30 0.00 1 0.00 1 0 25 7.793e-01 4.727e-02 3.125e-01 1.482e-02 7.510655e-01 9.988168e-03 1.867729e-02 -6.000000e+00 5.274929e-01 227.34 -2.00 3.25 -2.00 322.36 0.00e+00 8.270583e-02 7.230096e-03 6.643186e-03 -6.000000e+00 3.630147e-02 290.74 -2.00 20.00 -2.00 321.88 0.00e+00 9.084 0.009 302.00 328.00 3 8.0082e-01 4.6360e-02 1.0547e-01 -6.0000e+00 1.3151e+00 1.6715e+00 6.0118e-02 1.0949e-01 -6.0000e+00 1.4484e+00 -1.8299e+00 4.4610e-02 2.7847e-02 -6.0000e+00 8.5884e-01 6.4576e-01 2.0236e-02 5.9321e-02 -6.0000e+00 3.5784e-01 1.1443e-05 -6.0366e-04 5.3799e-04 1.3489e-03 -6.0000e+00 2.9890e-02 3.2296e-02 -2.3682e-05 12 8 8 10 0 0 55.39 27.81 1.31 0.03230 0.02776 38 4 1 5 0 1456.150 35.75 20.00 27.81 28.89 0.0 948.13 900000 900000 900000 900000 367 6975 -12169 -53529 900000 73155 900000 -106261 900000 900000 900000 48333 900000 900000 900000 900000 900000 226193 900000 900000 900000 900000 149379 900000 -31014 900000 900000 900000 5959 900000 -3748 65948 -45011 130949 359435 900000 900000 900000 900000 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7020 437 3593 4845 3887 5361 -12734 1508 5630 -9638 5555 -7817 552 7893 -3613 -106 4176 4479 1825 1580 -4734 3194 267 2463 6772 3290 624 -4897 -63 6123 -2104 7905 -2230 519 -11501 -5898 1023 -1586 8310 -3821 -2301 -3162 7655 3255 -4181 -1676 1028 -3152 -3592 2735 -3979 5145 -772 -7111 9405 6909 -2492 4587 -1242 3610 -5394 9800 5449 -7423 -6551 -4232 6047 2935 1265 -805 -7609 4000 SS 20251006T130831.2Z 9410.547584 240 1 54.67 2 82.11 100.93 106.95 283.84 0.00 1 0.00 1 0 17 4.832e-01 1.284e-02 2.047e-01 2.439e-03 7.298721e-01 1.447086e-03 7.646448e-03 -6.000000e+00 3.096986e-01 227.34 -2.00 3.25 -2.00 321.30 0.00e+00 -1.594134e-04 8.111121e-04 2.626806e-03 -6.000000e+00 1.527204e-02 290.74 -2.00 20.00 -2.00 320.67 0.00e+00 6.793 0.004 302.00 328.00 3 9.3820e-01 5.3899e-03 7.6031e-02 -6.0000e+00 7.6887e-01 1.1807e-01 7.6987e-03 4.0509e-02 -6.0000e+00 8.3608e-01 -2.0145e-01 7.3615e-03 2.0062e-02 -6.0000e+00 4.9856e-01 7.3364e-02 3.3686e-03 5.4478e-03 -6.0000e+00 2.0575e-01 1.5029e-04 -3.5410e-04 7.8785e-05 9.6639e-05 -6.0000e+00 1.7550e-02 3.2481e-02 -9.6154e-05 12 8 8 10 0 0 27.96 27.80 0.47 0.03248 0.02982 169 16 1 5 0 323.450 35.75 19.99 27.80 29.39 0.0 952.49 -149322 -165109 92190 -32962 -241082 -189621 -160685 -19342 -47915 -177102 900000 -146102 -144917 900000 900000 -59578 -20564 900000 900000 26951 900000 -22561 900000 12570 1347 -146531 -38828 9440 -55610 38398 25976 19456 -15725 27823 -29490 900000 -29570 4589 -14137 32350 35217 14035 29872 -13196 2194 -11505 -4696 31651 3945 12928 7556 20765 7705 22138 10 4516 3041 4246 1937 4314 -1689 2321 12428 -2666 -2749 -354 7060 4956 -487 4152 3477 4031 -771 1266 2287 887 2899 -6762 -775 -395 -4406 -428 -3493 -296 831 78 638 1607 1799 1986 -2493 -511 -391 16 -419 1477 70 514 -985 -1688 -288 -1957 -199 -847 -114 -2771 -1192 -319 -212 962 -25 13 107 424 12 -78 574 -24 313 -327 66 115 666 1584 -24 165 569 351 797 4 -106 -248 -149 -70 -295 57 -223 498 451 82 -147 -635 -397 -613 -891 219 -78 -2915 -1433 -1006 -46 -124 -1874 900000 -1577 -1940 900000 900000 -617 -181 900000 900000 186 900000 -279 900000 128 17 -8317 -765 117 -1387 419 376 351 -452 548 -1065 900000 -1292 170 -759 1275 1514 807 1539 -1078 157 -973 -385 1902 336 1108 764 2061 964 2613 2 713 500 691 320 702 -307 446 2411 -660 -718 -92 1764 1352 -156 1415 1176 1404 -278 467 771 281 875 -2358 -287 -155 -2092 -222 -2061 -183 543 55 463 1179 1310 1395 -1741 -336 -256 11 -327 1196 66 544 -1045 -1812 -315 -2020 -191 -815 -114 -3013 -1365 -364 -267 1335 -35 19 164 639 18 -113 826 -36 489 -528 106 178 996 2266 -36 243 834 505 1270 8 -197 -499 -299 -150 -675 129 -520 1169 1052 184 -336 -1387 -850 SS 20251006T132437.0Z 9410.558761 245 1 54.74 2 78.71 103.08 110.14 286.14 0.00 1 0.00 1 0 17 2.008e-01 6.844e-03 1.374e-02 7.029e-04 5.650027e-01 3.886116e-04 6.044195e-03 -6.000000e+00 1.272141e-01 227.34 -2.00 3.25 -2.00 319.81 0.00e+00 1.198632e-03 1.312119e-04 9.792250e-04 -6.000000e+00 5.971899e-03 290.74 -2.00 20.00 -2.00 319.01 0.00e+00 4.931 0.001 302.00 328.00 3 6.2957e-01 1.1507e-03 5.5121e-02 -6.0000e+00 3.1423e-01 2.0648e-02 1.3917e-03 2.7567e-02 -6.0000e+00 3.3975e-01 -5.3056e-02 1.1004e-03 1.3632e-02 -6.0000e+00 2.0359e-01 1.4931e-02 5.6049e-04 3.9322e-03 -6.0000e+00 8.4746e-02 1.3154e-03 -2.2798e-04 2.3147e-05 6.1691e-05 -6.0000e+00 7.2514e-03 3.1654e-02 -8.5793e-05 11 8 0 10 0 0 15.77 27.75 0.34 0.03165 0.02994 581 56 1 5 0 94.200 35.75 20.00 27.75 30.87 0.0 963.95 -71409 -78056 -56379 -66254 -87976 -83020 -73212 -56001 -42649 -57570 -43630 -43169 -37382 -17713 -12066 -20317 -16663 -5970 -2893 -7647 -6913 -9282 2603 -7464 -8596 -23206 -10322 -9088 -9185 -6863 -6064 -5248 -3716 -2127 -6962 1543 -4713 -2334 -1540 1228 1128 921 2055 -1250 108 393 -64 1340 596 1470 1735 2382 2390 2731 937 1854 1066 767 523 1232 1335 2165 2972 1820 1065 210 1087 998 962 1483 745 844 37 149 -68 -721 -780 -1571 -1008 -1132 -1739 -1425 -2088 -1624 -516 -528 -64 82 625 628 142 323 -172 141 290 452 78 371 -95 -643 -608 -818 -689 -164 -458 -1322 -975 -414 -9 414 386 195 82 148 63 232 372 222 302 45 -195 7 496 453 408 491 109 641 800 126 -60 -175 -209 -97 15 -22 -145 241 199 -271 -181 -284 -391 -964 -1252 -758 -976 -1592 -1474 -1285 -925 -684 -1176 -864 -994 -987 -470 -361 -763 -675 -237 -119 -348 -324 -463 122 -417 -519 -1683 -666 -581 -605 -480 -477 -466 -357 -211 -741 159 -582 -332 -235 211 215 189 437 -283 25 91 -15 324 152 400 516 775 776 950 351 715 423 306 208 493 561 982 1357 905 551 110 566 544 532 903 494 579 25 98 -41 -439 -454 -944 -615 -791 -1306 -1122 -1808 -1504 -475 -516 -66 85 642 623 134 306 -160 135 286 475 88 465 -120 -820 -738 -978 -783 -187 -547 -1604 -1254 -542 -13 609 586 308 129 227 96 343 552 342 466 73 -314 11 789 694 602 733 162 937 1269 211 -104 -313 -394 -186 28 -44 -296 498 408 -563 -360 -562 -763 SS 20251006T133003.8Z 9410.562544 248 1 54.73 2 77.57 103.83 111.21 286.94 0.00 1 0.00 1 0 17 1.368e-01 6.618e-03 7.540e-03 5.368e-04 5.220668e-01 2.942297e-04 5.599080e-03 -6.000000e+00 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