File name: Pandora257s1_AustinTX_20240507_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240511T135324.4Z 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_20240507_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: 20240507 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 20240507T125157.6Z 8893.536083 72 1 54.72 2 76.39 78.00 70.05 82.46 0.00 1 0.00 1 0 17 3.814e-01 1.893e-02 1.755e-01 4.472e-03 5.232615e-01 2.582148e-03 5.587275e-03 -6.000000e+00 2.462653e-01 230.52 -2.00 3.25 -2.00 320.49 0.00e+00 2.794686e-03 1.067805e-03 1.053492e-03 -6.000000e+00 1.217274e-02 288.31 -2.00 20.00 -2.00 319.76 0.00e+00 4.149 0.001 302.00 328.00 3 4.3061e+00 8.1587e-03 4.8088e-02 -6.0000e+00 6.1588e-01 3.7258e-02 1.0416e-02 2.6306e-02 -6.0000e+00 6.6812e-01 -5.1587e-02 9.0076e-03 1.3606e-02 -6.0000e+00 3.9680e-01 1.5555e-02 4.3955e-03 4.3403e-03 -6.0000e+00 1.6262e-01 6.8408e-05 -2.2419e-03 1.5929e-04 6.6402e-05 -6.0000e+00 1.3937e-02 3.0731e-02 -5.0865e-04 12 8 8 10 0 0 99.99 28.11 0.32 0.03073 0.01388 92 9 1 5 0 594.660 36.00 20.00 28.11 30.86 0.0 978.45 81277 -38662 -69549 900000 -109982 -101048 -140319 -117695 229913 -45362 900000 -44526 -25899 900000 97775 -42576 6768 900000 900000 166476 900000 34198 900000 66964 13701 -47450 8108 -16690 -26488 62842 -2309 14798 7890 36714 -9527 900000 -32210 -13171 -5603 12819 10845 17704 26306 -17884 -3051 -8712 -594 21139 11534 9691 7314 26904 3492 16585 -9392 -1372 2262 1593 -595 496 -13412 -1393 18760 -1973 -2466 -4599 14334 6057 -1580 3901 156 6011 -2013 1879 4385 491 794 -7261 -2143 -1899 -1633 -2751 -4833 -1751 2072 -3264 802 1369 2296 2203 -3640 45 314 -1205 1128 2946 494 895 -1813 -915 -409 -2342 273 279 1033 -2823 -931 -18 754 1568 -241 -463 -5 1183 -173 59 299 575 132 296 -77 -972 706 2239 -1409 401 456 391 1336 -284 -1298 -538 228 377 -1371 58 -548 1249 1386 -379 -158 -720 -328 354 -337 -853 900000 -1959 -1680 -3721 -2749 1001 -611 900000 -758 -441 900000 697 -1416 168 900000 900000 1015 900000 834 900000 1312 483 -3182 314 -828 -1488 1560 -124 754 471 1711 -718 900000 -3576 -1417 -659 1440 1374 2243 3196 -3473 -521 -1601 -102 3010 1883 1717 1443 4768 847 3770 -2908 -406 656 465 -177 148 -4830 -483 5816 -806 -1038 -1964 5056 2408 -736 1899 85 3201 -1152 987 2085 224 344 -3459 -1058 -1063 -1038 -1795 -3508 -1321 1606 -2831 698 1213 2005 1859 -3072 35 232 -927 921 2658 515 1030 -2269 -1134 -481 -2621 284 291 1122 -3375 -1159 -23 1067 2191 -367 -732 -8 1767 -250 82 414 823 200 462 -122 -1521 1055 3460 -2166 585 653 577 2110 -457 -2273 -992 438 763 -2752 120 -1179 2683 2965 -803 -321 -1526 -680 SS 20240507T131001.0Z 8893.548622 78 1 54.71 2 72.56 80.06 66.26 84.40 0.00 1 0.00 1 0 17 5.460e-02 5.934e-03 5.323e-03 6.665e-04 4.410332e-01 3.683989e-04 4.736488e-03 -6.000000e+00 3.503765e-02 230.52 -2.00 3.25 -2.00 318.62 0.00e+00 6.511713e-04 8.250809e-05 3.269814e-04 -6.000000e+00 1.607498e-03 288.32 -2.00 20.00 -2.00 317.79 0.00e+00 3.289 0.000 302.00 328.00 3 2.1664e+00 1.0148e-03 3.8615e-02 -6.0000e+00 8.7295e-02 3.6280e-03 1.1596e-03 2.1338e-02 -6.0000e+00 9.4175e-02 -1.5880e-02 7.7225e-04 1.0340e-02 -6.0000e+00 5.6197e-02 1.4343e-03 3.9329e-04 2.8941e-03 -6.0000e+00 2.3212e-02 1.4457e-03 -9.8934e-05 2.2844e-05 4.1058e-05 -6.0000e+00 1.9737e-03 2.4609e-02 -5.6487e-05 10 0 0 10 0 0 99.99 28.12 0.32 0.02461 0.02387 350 34 1 5 0 156.280 36.00 20.00 28.12 31.20 0.0 981.29 -16687 -16010 -22547 -17863 -21135 -23966 -20021 -20718 -13242 -13270 -8360 -13634 -8370 -3035 -2804 -4795 -1295 1292 2354 920 1164 118 2865 -94 -1364 -2888 -2294 -3702 -2337 1164 -723 136 158 -654 -2984 1429 -2250 -1662 -493 -9 -583 170 735 -887 -244 -162 -158 653 60 274 1051 1629 812 1754 402 618 1088 755 583 751 684 1573 2101 1437 325 -484 358 274 494 1274 277 386 -154 247 36 -374 -396 -929 -640 -653 -1408 -1452 -2063 -1604 -873 -714 -106 131 589 306 79 354 131 110 663 439 137 456 24 -447 -549 -720 -612 -13 -168 -1076 -831 -486 -229 364 354 141 64 0 -87 119 484 442 325 261 -69 -170 438 423 325 608 201 621 968 138 88 -168 -286 -81 -34 54 -195 242 272 -334 -280 -343 -520 -550 -572 -884 -656 -782 -925 -799 -921 -599 -646 -419 -809 -550 -223 -239 -470 -134 140 267 110 144 15 375 -14 -190 -422 -334 -539 -336 169 -117 24 30 -131 -621 297 -539 -462 -146 -3 -219 62 278 -349 -97 -65 -63 262 25 119 487 812 407 927 226 358 638 445 342 445 395 967 1392 952 221 -326 235 185 358 1006 224 324 -130 199 28 -275 -274 -647 -476 -513 -1188 -1361 -2001 -1657 -907 -787 -116 146 652 344 84 369 131 111 677 500 167 580 31 -579 -710 -874 -743 -16 -206 -1403 -1093 -678 -327 533 551 218 98 0 -126 171 691 653 485 405 -109 -265 661 641 471 845 287 863 1429 212 139 -282 -483 -138 -61 99 -366 462 517 -625 -503 -616 -920 SS 20240507T131849.7Z 8893.554742 85 1 11.08 2 70.68 81.07 64.40 85.35 0.00 1 0.00 1 0 17 5.526e-02 7.049e-03 1.776e-02 2.565e-03 4.033287e-01 1.415245e-03 4.345351e-03 -6.000000e+00 3.546792e-02 230.52 -2.00 3.25 -2.00 318.44 0.00e+00 -6.806846e-06 3.003276e-04 3.493538e-04 -6.000000e+00 1.626966e-03 288.32 -2.00 20.00 -2.00 317.61 0.00e+00 2.988 0.000 302.00 328.00 3 3.4431e+00 3.8668e-03 3.5157e-02 -6.0000e+00 8.8368e-02 5.0264e-03 4.4118e-03 1.9540e-02 -6.0000e+00 9.5328e-02 -1.4494e-03 2.8856e-03 9.4457e-03 -6.0000e+00 5.6885e-02 -3.7105e-03 1.4582e-03 2.5624e-03 -6.0000e+00 2.3500e-02 5.5796e-04 1.0219e-05 8.9197e-05 3.6734e-05 -6.0000e+00 1.9976e-03 2.4105e-02 -3.7508e-05 12 9 1 12 1 1 99.79 28.13 0.23 0.02411 0.02418 16 8 1 5 0 651.650 36.00 20.00 28.13 31.69 0.0 984.36 -6386 -28745 -20886 -6262 -24918 -26345 -10981 -17740 -1163 -17001 -14456 -11982 1104 289 375 -996 -676 5579 5497 838 10841 716 7153 1086 292 -4739 -1332 -898 -1840 -1780 -1532 1115 -1905 602 -4305 4774 -3870 -3738 -107 489 -405 566 1302 -1995 -1102 186 -1813 560 79 816 179 2326 1517 2253 -452 -811 954 280 581 1088 -87 1755 3073 441 -293 -668 1145 473 661 1768 571 348 -375 787 197 476 -282 -1537 -312 -1287 -1215 -1246 -1820 -1535 -559 -876 -366 148 678 436 -122 -80 202 474 815 693 -40 494 -237 -754 -673 -831 -633 -43 -15 -1119 -619 -201 -66 342 343 226 347 92 2 233 351 272 144 252 -274 -353 443 754 161 667 38 542 840 130 -249 -177 -472 230 176 26 -331 491 256 -302 -252 -426 -521 -233 -1424 -977 -248 -1153 -1252 -481 -919 -56 -1025 -911 -818 76 23 35 -105 -77 639 664 111 1332 100 981 168 48 -844 -229 -151 -310 -310 -288 224 -385 122 -927 977 -958 -1077 -35 167 -153 225 533 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