File name: Pandora257s1_AustinTX_20241206_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20241207T062757.4Z 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 v1.8.60 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20241206_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: 20241206 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 20241206T165906.0Z 9106.707708 172 1 2.33 2 56.49 156.83 100.72 105.13 0.00 1 0.00 1 0 17 1.968e-02 9.863e-03 1.244e-02 6.428e-03 2.284812e-01 3.512490e-03 2.591155e-03 -6.000000e+00 1.234790e-02 224.34 -2.00 3.25 -2.00 316.02 0.00e+00 5.820352e-04 3.979373e-04 6.059941e-05 -6.000000e+00 5.728740e-04 285.47 -2.00 20.00 -2.00 315.30 0.00e+00 1.805 0.000 302.00 328.00 3 4.5488e+00 9.0224e-03 2.0596e-02 -6.0000e+00 3.0347e-02 2.5220e-02 1.0085e-02 1.0804e-02 -6.0000e+00 3.2897e-02 5.1346e-03 5.7807e-03 5.3199e-03 -6.0000e+00 1.9695e-02 -7.3252e-03 2.5913e-03 1.5739e-03 -6.0000e+00 8.2110e-03 7.3686e-04 -2.0089e-05 2.2758e-04 2.5400e-05 -6.0000e+00 7.1009e-04 2.3120e-02 -1.0142e-04 12 9 9 12 1 1 999.00 25.70 0.12 0.02312 0.02297 1 5 1 5 0 1161.280 34.50 20.00 25.70 15.62 0.3 857.16 -2652 -5670 -4647 -5230 -9089 -3712 -2244 -673 1970 -3841 1437 3238 1024 6241 5120 164 -1512 3619 4949 1899 1250 -1470 2475 4139 325 560 -2508 -1658 -38 3273 2441 1773 -289 -1162 -5326 1025 -3831 -1769 -2355 -196 -1886 -718 -27 -622 -2909 -738 -1112 -502 716 719 2398 2270 356 865 68 929 834 1620 958 742 881 529 1952 609 232 -484 825 -374 271 469 124 142 -430 -443 350 536 631 -1204 -1341 -1561 -1119 -1721 -2274 -858 402 -85 -48 -756 -395 830 -522 -817 1067 419 855 392 1121 1542 -1053 -70 321 -811 94 1341 270 -1381 -1454 -593 342 749 620 8 55 454 -895 -882 1076 -572 -210 8 -270 196 -405 1266 419 93 551 541 1242 271 -276 12 -709 603 -515 -8 113 465 362 -566 -516 453 -995 -536 -1241 -1001 -1082 -1854 -709 -443 -141 430 -924 338 793 282 1821 1666 55 -544 1283 1786 724 487 -596 988 1686 143 248 -1124 -709 -15 1280 997 768 -133 -544 -2582 478 -1893 -982 -1410 -129 -1279 -505 -19 -453 -2163 -532 -789 -347 484 492 1678 1677 282 666 54 749 678 1305 773 606 745 475 1722 562 212 -424 722 -328 249 439 125 140 -426 -449 329 490 532 -1002 -1158 -1472 -1091 -1738 -2474 -925 455 -103 -58 -939 -487 974 -611 -935 1120 432 912 431 1340 1886 -1378 -90 393 -996 110 1590 324 -1782 -1880 -797 478 1046 898 11 79 632 -1175 -1154 1367 -763 -281 11 -391 281 -572 1693 565 120 685 673 1596 371 -378 18 -1036 859 -777 -12 176 733 574 -890 -789 697 -1534 SS 20241206T170733.4Z 9106.713581 175 1 2.96 2 55.80 159.03 99.01 106.06 0.00 1 0.00 1 0 17 8.556e-03 6.134e-03 2.464e-03 1.530e-03 2.201408e-01 8.425238e-04 2.495067e-03 -6.000000e+00 5.365676e-03 224.34 -2.00 3.25 -2.00 315.45 0.00e+00 4.353100e-04 8.402937e-05 2.833173e-05 -6.000000e+00 2.490179e-04 285.47 -2.00 20.00 -2.00 314.77 0.00e+00 1.774 0.000 302.00 328.00 3 2.7488e+00 2.1500e-03 2.0098e-02 -6.0000e+00 1.3187e-02 -6.4275e-03 2.3946e-03 1.0337e-02 -6.0000e+00 1.4296e-02 6.9830e-03 1.3693e-03 5.0999e-03 -6.0000e+00 8.5588e-03 -5.4863e-03 5.9616e-04 1.4663e-03 -6.0000e+00 3.5671e-03 4.7312e-03 -1.7202e-04 5.4318e-05 2.4684e-05 -6.0000e+00 3.0866e-04 2.4588e-02 -1.2293e-04 12 1 1 12 1 1 96.50 25.72 0.38 0.02459 0.02330 16 30 1 5 0 173.900 34.25 20.00 25.72 16.22 0.3 861.13 -1391 -2163 -3047 -2995 -2662 -418 -323 361 802 -546 -2090 -467 -2 617 144 -104 -67 583 773 1232 892 572 1149 1145 776 181 -609 561 647 1506 1760 303 623 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570 451 496 619 397 -404 -227 191 404 771 855 378 1090 1404 300 553 -60 -199 125 240 -428 -394 81 95 -875 -597 -577 -883 SS 20241206T171935.3Z 9106.721937 182 1 13.87 2 54.94 162.24 96.59 107.39 0.00 1 0.00 1 0 17 1.734e-02 7.762e-03 5.302e-03 2.688e-03 2.171641e-01 1.465171e-03 2.449786e-03 -6.000000e+00 1.088300e-02 224.34 -2.00 3.25 -2.00 316.14 0.00e+00 6.719172e-04 1.700208e-04 4.258800e-05 -6.000000e+00 5.045595e-04 285.47 -2.00 20.00 -2.00 315.42 0.00e+00 1.736 0.000 302.00 328.00 3 5.1543e+00 3.7735e-03 1.9730e-02 -6.0000e+00 2.6747e-02 2.2603e-02 4.2191e-03 1.0261e-02 -6.0000e+00 2.8990e-02 7.7841e-03 2.4204e-03 5.0381e-03 -6.0000e+00 1.7356e-02 -6.6629e-03 1.0871e-03 1.5264e-03 -6.0000e+00 7.2397e-03 4.3846e-04 7.8183e-04 9.5599e-05 2.3691e-05 -6.0000e+00 6.2547e-04 2.2749e-02 3.7573e-05 12 9 1 12 33 1 99.93 25.76 0.59 0.02275 0.02862 8 3 1 5 0 1540.330 34.50 20.00 25.76 16.25 0.3 861.45 -3522 -5637 -2803 1 -11714 -6306 -443 1467 1506 -2531 2603 -663 1513 3821 5066 238 -916 3211 1179 -1411 1552 413 1244 2166 -401 -1984 -1795 593 -175 1543 1366 1379 -352 818 -1790 2928 -2884 -1389 741 -843 -9 -486 -340 -677 -592 -271 -1615 1535 -644 295 1228 1918 -474 1085 332 124 -515 1240 -370 1462 568 1355 1937 1031 -553 -317 24 -62 1137 1073 -415 20 39 62 -63 1060 -253 -1185 -563 -903 -1761 -2041 -1906 -1868 -516 -731 5 -408 269 -145 -37 37 351 48 680 777 589 813 95 -364 30 -658 -164 24 -56 -882 -558 -584 -106 855 697 428 -130 183 14 -339 67 234 -157 358 -250 -487 353 308 170 572 674 1065 1105 233 1 -241 2 40 -230 100 -62 127 376 -411 -352 -563 -581 -724 -1240 -595 0 -2457 -1235 -86 300 328 -596 600 -167 408 1020 1469 78 -317 1105 426 -537 581 158 483 864 -170 -863 -765 237 -68 585 536 569 -154 355 -791 1264 -1442 -718 433 -519 -6 -339 -242 -488 -426 -193 -1139 1027 -435 200 855 1396 -371 870 256 98 -411 970 -293 1148 466 1168 1754 972 -522 -284 20 -52 993 1016 -399 20 39 59 -60 921 -206 -1015 -496 -807 -1748 -2066 -2063 -2010 -583 -878 6 -494 343 -178 -43 42 370 49 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