File name: Pandora257s1_AustinTX_20250614_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250615T063950.2Z 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_20250614_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: 20250614 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 20250614T123522.6Z 9296.524567 223 1 54.79 2 77.72 70.04 73.25 227.50 0.00 1 0.00 1 0 17 5.829e-01 1.105e-02 1.775e-01 2.710e-03 5.640535e-01 1.538443e-03 5.970941e-03 -6.000000e+00 3.746706e-01 230.98 -2.00 3.25 -2.00 320.49 0.00e+00 1.718423e-03 6.414293e-04 1.410711e-03 -6.000000e+00 1.771628e-02 291.36 -2.00 20.00 -2.00 319.74 0.00e+00 4.562 0.001 302.00 328.00 3 3.1704e+00 4.9486e-03 5.2600e-02 -6.0000e+00 9.3298e-01 3.3963e-02 6.3260e-03 2.8648e-02 -6.0000e+00 1.0059e+00 -4.3397e-02 5.4074e-03 1.4495e-02 -6.0000e+00 6.0100e-01 8.4738e-03 2.6522e-03 4.2674e-03 -6.0000e+00 2.4884e-01 1.4076e-04 -2.1449e-04 9.1731e-05 6.9319e-05 -6.0000e+00 2.1196e-02 2.9254e-02 -7.3536e-05 12 8 8 10 0 0 99.98 28.10 0.34 0.02925 0.02764 135 13 1 5 0 405.820 36.00 20.00 28.10 31.01 0.0 967.41 -56049 -73046 -92752 900000 -154836 -134219 -83172 -45524 -26545 -114361 135004 -47667 -39651 398078 346705 -37669 27576 128932 81642 43971 114056 -15507 150259 24645 9132 -20275 -17296 684 -16349 10478 9824 -6486 -19843 14534 -8312 93865 -15193 3960 -9237 4826 -183 -5067 8977 -9797 -1425 -5807 -5186 13425 -1871 4711 5162 12298 3277 12173 -3501 721 367 1550 -1080 437 -2952 -1108 8376 -455 -2976 -1177 5855 3802 -966 2238 917 1493 -959 362 1880 1451 2480 -4421 -161 -952 -1836 -943 -2827 -1267 892 -915 62 1125 630 1660 -2191 -722 -641 -272 121 1660 481 360 -658 -1228 -379 -1294 725 266 -508 -1868 -430 48 17 1165 -29 590 -172 975 -108 -27 186 -52 9 -312 -194 -244 -275 2019 -80 214 85 -132 794 -89 -93 -435 4 -350 -295 168 -431 657 588 228 -379 -548 -260 -377 -649 -1047 900000 -3199 -2321 -939 -394 -210 -2390 357 -664 -619 1052 916 -1075 459 852 928 767 1025 -529 1032 638 294 -911 -763 25 -739 393 421 -372 -1431 780 -573 2456 -1329 337 -1064 559 -25 -774 1248 -1691 -231 -1002 -909 2015 -343 868 1035 2525 802 2927 -1040 214 111 465 -331 134 -981 -393 2970 -173 -1194 -463 2157 1492 -434 1078 484 811 -530 188 894 640 1033 -2014 -77 -525 -1168 -666 -2223 -1053 711 -788 56 1015 569 1431 -1855 -622 -536 -233 104 1582 526 437 -790 -1484 -468 -1507 787 291 -587 -2317 -515 61 24 1747 -43 925 -271 1471 -170 -41 283 -82 14 -497 -309 -383 -450 3109 -121 312 123 -197 1273 -146 -167 -831 8 -695 -618 368 -979 1499 1337 505 -808 -1123 -522 SS 20250614T124054.8Z 9296.528412 226 1 54.65 2 76.59 70.64 74.10 228.42 0.00 1 0.00 1 0 25 1.569e-01 6.586e-03 1.875e-02 1.054e-03 5.353750e-01 5.874850e-04 5.670039e-03 -6.000000e+00 1.007682e-01 230.98 -2.00 3.25 -2.00 319.65 0.00e+00 8.063016e-04 1.866635e-04 7.141972e-04 -6.000000e+00 4.678412e-03 291.36 -2.00 20.00 -2.00 318.83 0.00e+00 4.205 0.001 302.00 328.00 3 2.0258e+00 1.7187e-03 4.8648e-02 -6.0000e+00 2.5106e-01 2.3254e-02 2.0572e-03 2.6231e-02 -6.0000e+00 2.7069e-01 -3.7121e-02 1.5786e-03 1.2791e-02 -6.0000e+00 1.6177e-01 5.5791e-03 8.0548e-04 3.5831e-03 -6.0000e+00 6.6925e-02 6.3846e-04 -2.7687e-04 3.5142e-05 5.3631e-05 -6.0000e+00 5.6734e-03 2.9085e-02 -1.0189e-04 11 8 0 10 0 0 97.21 28.10 0.28 0.02908 0.02700 223 22 1 5 0 245.050 36.00 20.00 28.10 31.19 0.0 969.31 -44810 -40501 -59674 -52821 -79092 -59672 -49490 -53340 -29331 -59146 -17571 -34642 -33049 5166 238 -20149 -5096 1911 4174 -2616 7581 -12298 8784 -1118 -4152 -11003 -10646 -5906 -8968 -3583 -3679 -2385 -4517 351 -4140 6782 -6521 -1630 -2391 1058 -919 -30 2139 -2362 -124 -1255 -625 2317 189 1014 2475 3668 1300 3649 280 732 940 1443 451 745 475 1573 3145 847 -61 -526 1328 925 260 1482 488 497 -197 64 243 265 353 -1915 -540 -863 -1449 -1365 -2127 -1474 -263 -383 106 211 628 456 -354 214 -38 84 541 462 264 303 -227 -666 -370 -729 -563 21 -267 -1290 -796 -431 -68 501 221 101 34 117 -71 247 451 347 297 67 -169 -33 392 646 143 336 188 541 855 72 -91 -254 -282 -163 -19 9 -232 353 349 -132 -197 -362 -398 -608 -583 -1080 -885 -1699 -1086 -885 -1108 -531 -1575 -341 -922 -1040 134 8 -918 -222 84 193 -136 369 -757 463 -70 -285 -839 -816 -431 -689 -281 -324 -234 -495 38 -483 746 -920 -258 -451 203 -199 -7 503 -597 -31 -324 -163 602 52 297 779 1250 452 1328 111 300 393 601 189 314 211 748 1610 439 -33 -282 700 509 157 975 325 343 -136 42 159 160 203 -1146 -348 -588 -1133 -1113 -1906 -1408 -248 -384 111 225 664 466 -345 209 -36 81 532 482 312 373 -297 -877 -463 -856 -665 25 -314 -1619 -1056 -577 -98 743 335 158 53 185 -107 362 659 527 472 105 -268 -51 620 980 209 499 275 815 1317 117 -151 -451 -504 -308 -36 18 -479 707 727 -267 -383 -709 -765 SS 20250614T125114.3Z 9296.535582 229 1 54.71 2 74.48 71.76 75.72 230.09 0.00 1 0.00 1 0 25 7.567e-02 5.981e-03 6.081e-03 6.412e-04 4.721726e-01 3.555640e-04 5.046001e-03 -6.000000e+00 4.860450e-02 230.98 -2.00 3.25 -2.00 318.86 0.00e+00 7.268453e-04 8.589589e-05 4.240246e-04 -6.000000e+00 2.256404e-03 291.36 -2.00 20.00 -2.00 317.98 0.00e+00 3.668 0.001 302.00 328.00 3 1.7031e+00 9.9208e-04 4.2513e-02 -6.0000e+00 1.2110e-01 1.0248e-02 1.1455e-03 2.2907e-02 -6.0000e+00 1.3056e-01 -3.1877e-02 7.7793e-04 1.1106e-02 -6.0000e+00 7.8028e-02 7.5887e-03 3.9724e-04 3.1067e-03 -6.0000e+00 3.2283e-02 1.5667e-03 -1.6226e-04 2.1705e-05 4.3315e-05 -6.0000e+00 2.7363e-03 2.8841e-02 -9.1598e-05 10 0 0 10 0 0 93.51 28.11 0.33 0.02884 0.02762 340 33 1 5 0 160.890 36.00 20.00 28.11 31.81 0.0 973.82 -26856 -20651 -28740 -26808 -33542 -28614 -27419 -22828 -18365 -24939 -13448 -19545 -13129 -2457 -642 -4883 -2482 124 1776 1103 -502 -2387 2879 -902 -1480 -3100 -3528 -2817 -3092 -655 -1084 -1129 -1349 -1413 -4168 1264 -2306 -1227 -724 477 -152 -22 838 -518 457 -122 -110 736 -84 520 1623 1974 1021 2050 854 1061 981 768 212 745 1227 1597 2188 1300 44 -82 649 452 818 961 354 421 63 115 -320 -550 -357 -1260 -608 -821 -1477 -1358 -1968 -1630 -788 -573 -240 24 375 370 202 282 144 141 501 401 150 368 -42 -595 -542 -683 -559 42 -226 -1073 -723 -353 -181 330 282 106 61 91 -18 184 351 348 340 216 -121 17 409 472 422 543 190 623 853 121 17 -159 -210 -136 56 -10 -190 289 247 -271 -248 -388 -566 -752 -595 -924 -831 -1089 -902 -922 -814 -688 -1078 -564 -989 -734 -147 -44 -395 -216 11 169 111 -53 -264 317 -110 -193 -423 -485 -380 -422 -92 -154 -179 -232 -252 -777 234 -493 -304 -193 144 -51 -8 286 -183 162 -44 -40 270 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