File name: Pandora257s1_AustinTX_20240705_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240706T064120.1Z 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 v1.8.59 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20240705_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: 20240705 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 20240705T123604.1Z 8952.525048 70 1 54.68 2 78.74 70.16 72.91 67.38 0.00 1 0.00 1 0 17 4.628e-01 1.111e-02 1.623e-01 2.584e-03 6.036253e-01 1.485067e-03 6.435973e-03 -6.000000e+00 2.975124e-01 230.41 -2.00 3.25 -2.00 320.64 0.00e+00 7.474042e-04 6.558754e-04 1.901795e-03 -6.000000e+00 1.441457e-02 292.60 -2.00 20.00 -2.00 319.88 0.00e+00 4.941 0.001 302.00 328.00 3 2.7051e+00 4.8949e-03 5.7086e-02 -6.0000e+00 7.4037e-01 6.0223e-02 6.3692e-03 3.1893e-02 -6.0000e+00 7.9965e-01 -5.2718e-02 5.5242e-03 1.5422e-02 -6.0000e+00 4.7772e-01 1.0592e-02 2.6804e-03 4.0717e-03 -6.0000e+00 1.9864e-01 1.5000e-04 -4.1732e-04 8.6468e-05 7.0286e-05 -6.0000e+00 1.6853e-02 2.9039e-02 -1.4659e-04 12 8 8 10 0 0 99.98 28.41 0.42 0.02904 0.02590 143 14 1 5 0 382.360 36.25 20.00 28.41 32.70 0.0 988.52 900000 -101993 -107780 900000 -132330 -89109 -153363 -59109 -19308 -123292 250800 -84010 -62351 100242 13096 -30912 8449 91948 900000 42136 79816 -27449 264633 7519 -32250 -43335 -35727 -201 -14043 2770 -14604 -13966 -4887 41693 -8943 114956 -21193 -2108 -9554 14265 -4578 9364 20094 -13998 3059 -9540 -7568 7383 -184 5114 9548 12857 7675 9451 -4680 1699 1662 3458 -1854 -382 -1227 728 6516 -293 -3605 -1865 6602 3238 -650 1534 1156 2026 -653 736 856 299 3312 -3951 460 -1347 -1835 50 -3401 -2228 93 -788 -217 1257 1137 628 -2498 37 -69 677 592 628 -67 666 -587 -845 -472 -1242 437 -279 -53 -2003 -582 325 -269 1591 13 -100 -208 541 79 123 529 204 407 -107 -201 -612 993 1893 -967 73 -229 -16 925 -236 -291 -173 -466 -423 -141 154 -325 574 795 27 -270 -317 -272 900000 -864 -1012 900000 -1575 -714 -2563 -433 -106 -2117 632 -1289 -942 404 152 -646 134 695 900000 594 804 -843 666 187 -1283 -2008 -1557 -6 -513 93 -669 -728 -257 1449 -529 2084 -1692 -165 -958 1308 -565 1082 2186 -2203 414 -1497 -1193 1039 -29 838 1647 2370 1630 2126 -1285 456 456 934 -525 -108 -367 232 2164 -102 -1350 -689 2491 1205 -276 706 577 1039 -341 361 388 126 1298 -1708 210 -718 -1128 34 -2613 -1667 72 -658 -189 1099 989 530 -2057 30 -56 566 499 600 -73 743 -704 -1017 -539 -1442 473 -305 -61 -2279 -695 412 -375 2381 19 -159 -334 834 117 177 760 305 633 -172 -326 -974 1507 2952 -1490 108 -336 -25 1408 -401 -538 -318 -908 -873 -307 329 -719 1278 1756 57 -595 -669 -563 SS 20240705T124423.3Z 8952.530826 76 1 54.29 2 77.04 71.08 71.31 68.17 0.00 1 0.00 1 0 25 4.429e-01 4.876e-02 2.031e-01 1.121e-02 4.355990e-01 6.565259e-03 5.325695e-03 -6.000000e+00 2.880802e-01 230.41 -2.00 3.25 -2.00 320.47 0.00e+00 1.764018e-02 2.738072e-03 2.087406e-03 -6.000000e+00 1.557860e-02 292.60 -2.00 20.00 -2.00 319.68 0.00e+00 4.341 0.001 302.00 328.00 3 5.3230e+00 2.1328e-02 4.7262e-02 -6.0000e+00 7.2242e-01 1.8832e-01 2.7160e-02 2.2412e-02 -6.0000e+00 7.8545e-01 -2.2807e-01 2.1027e-02 2.3510e-02 -6.0000e+00 4.6575e-01 9.0020e-02 1.0077e-02 1.9518e-02 -6.0000e+00 1.9259e-01 2.1495e-05 1.7699e-03 4.2067e-04 2.1906e-04 -6.0000e+00 1.6469e-02 3.0490e-02 -2.0149e-04 12 8 8 10 0 0 99.97 28.42 1.73 0.03049 0.04379 33 3 1 5 0 1644.870 36.25 20.00 28.42 32.94 0.0 989.91 900000 181940 -1112 900000 -88810 -74963 -118491 -83127 900000 -94116 900000 -82875 900000 900000 900000 94367 157288 900000 900000 900000 900000 70235 900000 83602 20477 -53938 -42355 900000 -10385 11715 -10247 13699 30088 216199 24287 900000 -28401 -2844 8874 46329 35324 62519 114643 -11648 18596 -21642 -4968 43221 31431 44261 63576 113135 21408 50984 -15921 7922 -5097 -638 -925 5393 -6007 -1701 40764 4382 -19907 2313 60079 21985 -6669 4137 4119 4980 -6359 4353 8695 10381 32524 -22376 138 -3774 -3495 678 -13303 -6858 6634 -3727 -240 1309 3025 2299 -13380 -4787 3935 3973 700 6027 2031 -14 -3295 -1579 1451 -1858 6868 1780 3380 -4791 -898 2818 500 7446 -455 -3251 -1936 4218 1239 32 353 -1790 -1594 -2808 -93 -5695 5219 11175 -4651 -381 1894 -700 3723 -2735 -601 536 491 -396 -614 -75 -1757 1355 4352 2169 -2295 -2422 -921 900000 1983 -21 900000 -3609 -2526 -6106 -3048 900000 -4011 900000 -3942 900000 900000 900000 1590 1715 900000 900000 900000 900000 1879 900000 1906 873 -4811 -3358 900000 -638 639 -792 937 1879 2357 1637 900000 -3631 -350 1103 4394 4043 5793 6624 -2476 3021 -5403 -1072 5890 4968 6465 8178 9497 4761 8782 -5467 2159 -1578 -188 -274 1552 -2076 -617 10576 1734 -10156 925 13295 7310 -3177 1930 2048 2514 -3535 2064 3659 3972 9537 -11611 63 -2024 -2111 434 -10557 -5435 4889 -3226 -210 1150 2595 1913 -12238 -3768 2737 2824 559 5138 2032 -16 -4020 -1876 1589 -1969 6417 1780 3504 -5714 -1094 3539 693 10382 -661 -4961 -2864 6167 1771 46 499 -2693 -2522 -4677 -152 -9709 7755 15045 -7028 -533 2550 -1000 5471 -4645 -1069 992 863 -738 -1208 -153 -3764 2858 8885 4406 -4693 -4791 -1774 SS 20240705T124925.8Z 8952.534326 79 1 54.72 2 76.01 71.63 70.33 68.64 0.00 1 0.00 1 0 17 1.190e-01 6.667e-03 1.826e-02 1.129e-03 5.085000e-01 6.277463e-04 5.413161e-03 -6.000000e+00 7.629989e-02 230.41 -2.00 3.25 -2.00 319.46 0.00e+00 -5.806390e-05 1.877906e-04 6.079930e-04 -6.000000e+00 3.566437e-03 292.60 -2.00 20.00 -2.00 318.61 0.00e+00 4.042 0.001 302.00 328.00 3 2.3362e+00 1.8146e-03 4.6560e-02 -6.0000e+00 1.8976e-01 1.5697e-02 2.1547e-03 2.4892e-02 -6.0000e+00 2.0460e-01 -1.9587e-02 1.6049e-03 1.1979e-02 -6.0000e+00 1.2243e-01 5.7229e-04 8.2412e-04 3.2119e-03 -6.0000e+00 5.0804e-02 5.6144e-04 8.1670e-05 3.7930e-05 4.7461e-05 -6.0000e+00 4.3022e-03 2.7377e-02 -4.7022e-05 11 8 0 10 0 0 99.95 28.42 0.28 0.02738 0.02799 168 16 2 5 0 325.700 36.25 20.00 28.42 33.08 0.0 991.20 -27422 -35921 -41100 -29609 -49936 -55125 -52482 -38804 -17022 -44212 -503 -30702 -20541 -2585 -3655 -9030 -6335 4037 9309 -545 4574 -4510 15279 -4396 -10476 -10345 -8890 -4682 -9857 -3305 -5108 -4602 -2156 754 -4623 7758 -5309 -1581 -2527 2698 -1193 1221 3530 -2535 -864 -1332 -818 935 -1508 599 2177 2770 1539 3391 -196 735 779 1093 -138 628 765 1676 2919 1430 -377 -406 1371 1335 427 1249 517 613 72 193 288 -4 581 -1796 -122 -907 -1494 -1272 -2273 -1771 -578 -650 -224 228 629 698 -333 332 121 259 398 503 214 372 -61 -561 -575 -928 -455 87 -29 -1058 -735 -344 -277 527 219 107 -15 101 23 132 440 344 357 178 -300 -291 480 724 100 485 126 397 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