File name: Pandora257s1_AustinTX_20250207_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250208T214021.0Z 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 v1.8.70 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20250207_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: 20250207 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 20250207T183028.5Z 9169.771163 328 1 0.65 2 45.42 175.02 100.04 49.68 0.00 1 0.00 1 0 17 1.005e-02 7.630e-03 6.690e-03 5.053e-03 1.626824e-01 2.810114e-03 1.849425e-03 -6.000000e+00 6.316743e-03 224.88 -2.00 3.25 -2.00 314.46 0.00e+00 1.670186e-04 2.309304e-04 3.343258e-05 -6.000000e+00 2.897935e-04 283.34 -2.00 20.00 -2.00 313.90 0.00e+00 1.423 0.000 302.00 328.00 3 3.4108e+00 7.1146e-03 1.5786e-02 -6.0000e+00 1.5555e-02 1.2251e-02 7.8873e-03 7.6563e-03 -6.0000e+00 1.6861e-02 8.5867e-03 4.5221e-03 3.7691e-03 -6.0000e+00 1.0076e-02 -6.4111e-03 1.9078e-03 1.0766e-03 -6.0000e+00 4.1887e-03 3.7970e-03 3.3283e-04 1.7918e-04 1.9507e-05 -6.0000e+00 3.6239e-04 2.1457e-02 -5.5043e-05 12 9 1 12 1 1 999.00 28.07 0.30 0.02146 0.02396 1 16 1 5 0 320.950 36.00 20.01 28.07 30.03 0.0 962.82 -1427 826 -1664 -3061 -1424 -2373 325 1866 1559 -775 -681 -7 -600 -1254 3224 -232 379 1285 1953 928 -110 585 2095 1506 307 30 -627 -572 -883 1200 1951 901 689 -1320 -4000 -1750 -1214 -1214 -885 -282 -452 -1203 -479 -122 -367 -306 -582 -505 318 189 1131 1234 273 1520 -287 404 346 553 176 945 1052 905 678 871 -1049 -569 529 -981 1764 662 1457 61 -255 653 -253 -513 -572 -397 -338 -228 -1687 -1036 -1418 -1566 -933 -726 132 61 22 455 -407 334 896 413 1445 915 -159 102 -110 420 -468 -179 57 267 -292 -1135 -466 -548 -286 -184 -129 -258 -633 112 315 492 0 -331 474 661 -263 364 -351 585 471 339 380 1058 1496 880 149 71 -585 -99 27 28 -978 520 465 -155 -597 -679 -379 -560 328 -668 -1179 -542 -894 124 754 630 -330 -295 -3 -274 -631 1587 -125 200 688 1062 520 -63 336 1206 900 182 18 -369 -337 -498 686 1127 516 407 -796 -2444 -1067 -762 -828 -660 -224 -372 -1000 -404 -103 -309 -253 -491 -413 252 151 919 1048 234 1337 -253 360 310 493 157 844 972 850 670 849 -1020 -538 485 -897 1640 648 1462 65 -261 664 -252 -487 -520 -346 -302 -211 -1671 -1067 -1510 -1712 -1079 -862 158 75 27 535 -465 372 954 428 1522 1004 -185 124 -135 507 -561 -210 65 309 -348 -1399 -581 -714 -377 -245 -177 -354 -861 146 391 597 0 -413 601 859 -346 476 -466 765 586 416 464 1274 1793 1109 190 94 -768 -133 37 39 -1418 738 666 -227 -855 -949 -538 SS 20250207T184655.8Z 9169.782590 341 1 54.75 2 45.28 180.60 97.39 51.95 0.00 1 0.00 1 0 25 1.001e-02 6.845e-03 2.056e-03 1.291e-03 1.625862e-01 7.092168e-04 1.827776e-03 -6.000000e+00 6.298025e-03 224.88 -2.00 3.25 -2.00 315.36 0.00e+00 -3.511410e-05 6.874766e-05 4.292592e-05 -6.000000e+00 2.888698e-04 283.34 -2.00 20.00 -2.00 314.72 0.00e+00 1.419 0.000 302.00 328.00 3 5.5151e+00 1.8134e-03 1.5745e-02 -6.0000e+00 1.5509e-02 1.6318e-02 2.0149e-03 7.6286e-03 -6.0000e+00 1.6810e-02 1.3291e-02 1.1525e-03 3.7478e-03 -6.0000e+00 1.0046e-02 -7.7375e-03 5.0199e-04 1.0555e-03 -6.0000e+00 4.1768e-03 4.6332e-04 4.3853e-04 4.6017e-05 1.8147e-05 -6.0000e+00 3.6126e-04 2.1495e-02 -3.5285e-06 11 8 0 10 0 0 100.00 28.10 0.39 0.02150 0.02479 142 14 1 5 0 385.520 36.00 20.00 28.10 30.59 0.0 967.66 -112 -1315 -1772 -1510 -4534 -1134 -1012 46 332 -1303 112 -1399 -1457 1130 2103 -600 -904 1451 1633 1584 1647 -65 2493 1407 1106 -184 -511 -356 -866 999 1389 800 55 -322 -3596 1244 -2738 -299 -319 -296 -1112 -692 -155 -1263 -557 -726 -1128 111 -952 335 499 1937 777 1482 34 750 700 456 401 581 574 1401 1662 671 -540 -972 213 -26 153 1058 551 390 -129 249 384 103 -57 -1162 -163 -444 -1363 -1474 -2132 -1623 -751 -526 -62 208 309 416 -514 62 21 128 556 1010 288 425 50 -691 -406 -762 -168 -88 67 -1054 -667 16 -139 583 409 301 64 264 -21 175 -2 -136 241 299 -133 -294 509 910 237 241 185 333 1042 212 153 -119 14 -115 -29 1 -336 292 234 -49 -481 -443 -730 -30 -371 -495 -439 -1279 -303 -281 14 104 -390 37 -444 -497 412 821 -255 -399 642 738 730 768 -31 1185 699 568 -96 -263 -174 -406 451 634 381 27 -160 -1816 610 -1522 -170 -208 -217 -817 -529 -120 -998 -435 -559 -849 86 -735 256 392 1567 613 1204 28 639 600 391 343 500 511 1304 1622 677 -540 -920 188 -23 139 1027 535 394 -131 244 379 94 -48 -1019 -145 -394 -1338 -1459 -2269 -1821 -889 -616 -76 260 385 500 -623 68 22 137 608 1095 342 507 62 -858 -480 -918 -195 -105 84 -1320 -873 22 -197 803 581 428 87 360 -26 224 -2 -167 311 408 -187 -417 703 1203 301 311 230 411 1319 283 198 -158 20 -162 -43 1 -502 443 357 -74 -713 -641 -1045 SS 20250207T192338.5Z 9169.808085 363 1 21.83 2 46.21 192.92 91.20 56.63 0.00 1 0.00 1 0 17 2.481e-02 1.321e-02 8.106e-03 4.497e-03 1.582932e-01 2.446016e-03 1.764694e-03 -6.000000e+00 1.560479e-02 224.88 -2.00 3.25 -2.00 315.84 0.00e+00 1.707352e-04 2.642406e-04 2.287404e-05 -6.000000e+00 7.158205e-04 283.34 -2.00 20.00 -2.00 315.16 0.00e+00 1.443 0.000 302.00 328.00 3 6.6192e+00 6.2899e-03 1.5843e-02 -6.0000e+00 3.8428e-02 6.9696e-03 7.0178e-03 7.4341e-03 -6.0000e+00 4.1651e-02 3.5200e-02 4.0196e-03 3.6460e-03 -6.0000e+00 2.4892e-02 -1.7282e-02 1.7711e-03 1.0369e-03 -6.0000e+00 1.0348e-02 1.5076e-04 6.0693e-04 1.6050e-04 1.7248e-05 -6.0000e+00 8.9517e-04 2.1347e-02 -3.3518e-05 12 9 9 12 9 1 99.95 28.20 0.70 0.02135 0.02591 6 2 1 5 0 3117.940 36.00 20.00 28.20 31.47 0.0 973.99 -1359 -286 -1708 7535 -7059 -5918 -6047 -1244 -908 1540 694 -8230 -4681 3362 6039 -1215 -1218 2924 2106 5948 6794 -3110 5715 1373 2083 -2672 -2495 3570 -4150 733 713 1781 -3833 983 -7437 7112 -6316 -1662 -458 -692 917 -367 1634 43 473 -1830 -3003 442 -1474 -179 709 4127 -146 1564 18 399 -671 844 2000 1521 685 886 4045 24 -2279 -1568 1350 273 232 1185 587 1492 -802 -30 560 -139 670 -3790 -1786 -1614 -2754 -1109 -3505 -1291 -276 -57 164 111 27 138 -564 -494 1396 -675 633 2568 969 -86 315 -245 -181 -667 648 -883 83 -936 -188 317 151 1144 810 266 183 651 -583 -487 -1352 -64 118 -126 -241 -1028 884 1498 -560 -97 819 -9 370 -154 -260 -273 445 268 -122 -490 -912 586 1727 800 -1089 -519 -532 -322 -70 -415 1583 -1619 -1318 -1408 -297 -230 393 182 -2458 -1453 1056 2002 -459 -477 1128 839 2329 2673 -1364 2341 607 943 -1279 -1166 1498 -1796 297 293 752 -1762 431 -3500 2957 -3274 -940 -267 -454 638 -271 1207 33 354 -1381 -2234 308 -1026 -124 498 2932 -113 1233 14 331 -568 701 1637 1265 594 808 3759 23 -2258 -1454 1146 230 204 1120 597 1563 -789 -31 536 -122 541 -3069 -1452 -1415 -2672 -1148 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