File name: Pandora257s1_AustinTX_20250323_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250324T064138.1Z 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 v1.8.74 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20250323_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: 20250323 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 20250323T155455.3Z 9213.663140 287 1 16.34 2 48.17 119.09 66.50 212.17 0.00 1 0.00 1 0 17 1.360e-02 7.841e-03 6.011e-03 3.115e-03 1.973813e-01 1.717652e-03 2.164694e-03 -6.000000e+00 8.637640e-03 227.55 -2.00 3.25 -2.00 316.07 0.00e+00 4.511363e-04 1.938635e-04 6.208693e-05 -6.000000e+00 3.950428e-04 285.03 -2.00 20.00 -2.00 315.35 0.00e+00 1.497 0.000 302.00 328.00 3 5.7496e+00 4.4481e-03 1.7316e-02 -6.0000e+00 2.1391e-02 1.4148e-02 4.9635e-03 9.3044e-03 -6.0000e+00 2.3136e-02 1.6045e-02 2.8398e-03 4.5336e-03 -6.0000e+00 1.3812e-02 -9.0779e-03 1.2561e-03 1.3264e-03 -6.0000e+00 5.7213e-03 3.1387e-04 5.5572e-04 1.1080e-04 2.0570e-05 -6.0000e+00 4.9109e-04 2.2303e-02 -1.4470e-05 12 9 1 12 33 1 99.98 27.91 0.47 0.02230 0.02648 8 3 1 5 0 1815.220 35.75 20.00 27.91 29.44 0.0 958.52 -2841 -2140 -5764 2524 -4505 695 646 -1373 -1135 175 -1678 -3167 630 -18 656 -1568 -476 2096 2531 489 5436 1212 1785 1673 -531 -144 -1241 512 -1637 1550 1209 573 -1538 -1484 -4410 3107 343 -1875 131 174 -425 -857 30 -746 -84 -669 -1102 425 -1252 146 1180 2018 1037 2646 -572 627 -185 186 696 540 951 1574 1780 -1 -1602 -1553 249 290 -76 932 129 693 115 679 -158 316 993 -1377 -738 -881 -1236 -1659 -1827 -2476 -329 -385 -79 61 387 60 330 -466 150 178 324 1286 659 257 -1 -344 -18 -800 -448 285 -4 -603 -770 -460 156 800 636 -55 187 197 -13 121 84 -282 168 54 -482 -322 679 289 -82 702 828 58 990 -148 302 -462 109 165 -33 -19 -324 52 678 490 -905 -941 -292 -615 -480 -1327 509 -922 133 129 -302 -266 42 -420 -845 176 -6 202 -526 -165 732 905 182 1958 460 689 669 -224 -61 -522 203 -636 578 464 232 -658 -637 -1929 1290 160 -1023 81 110 -293 -622 22 -557 -63 -493 -797 295 -871 101 835 1488 809 2110 -447 492 -147 147 592 465 779 1354 1612 -1 -1516 -1391 207 239 -66 867 130 718 120 680 -149 272 849 -1162 -638 -764 -1182 -1733 -1898 -2747 -380 -472 -95 75 471 75 388 -509 163 187 353 1390 782 331 -2 -428 -23 -968 -524 338 -5 -751 -1009 -629 222 1182 911 -79 278 273 -17 159 110 -379 223 76 -697 -464 949 390 -106 916 1041 74 1286 -203 404 -640 153 241 -50 -29 -503 82 1071 764 -1392 -1410 -458 SS 20250323T163232.6Z 9213.689266 312 1 2.79 2 41.40 128.38 71.06 219.36 0.00 1 0.00 1 0 25 7.629e-03 6.113e-03 6.902e-04 5.139e-04 1.813940e-01 2.888059e-04 2.033329e-03 -6.000000e+00 4.844956e-03 227.55 -2.00 3.25 -2.00 314.57 0.00e+00 3.077564e-04 2.397255e-05 1.685299e-05 -6.000000e+00 2.215925e-04 285.03 -2.00 20.00 -2.00 313.97 0.00e+00 1.332 0.000 302.00 328.00 3 1.0494e+00 7.3559e-04 1.5580e-02 -6.0000e+00 1.1998e-02 5.2930e-03 8.1363e-04 8.5590e-03 -6.0000e+00 1.2977e-02 -2.7805e-03 4.6554e-04 4.1896e-03 -6.0000e+00 7.7473e-03 -2.7057e-03 1.9602e-04 1.1810e-03 -6.0000e+00 3.2091e-03 4.2198e-02 2.5735e-04 1.8270e-05 2.0951e-05 -6.0000e+00 2.7547e-04 2.2326e-02 -2.2540e-05 12 1 1 12 1 1 99.80 28.03 0.33 0.02233 0.02426 118 225 1 5 0 23.410 36.00 20.00 28.03 30.58 0.0 966.63 -534 -1278 -1727 -2352 -1872 -352 762 1254 553 -897 -1504 -244 388 492 311 -58 -159 529 679 1249 949 622 975 1213 746 187 -105 -541 288 1480 1394 1106 988 -711 -2238 -1041 -563 -351 -69 -602 -1207 -1168 -890 -851 -712 -349 -635 -379 -397 178 954 691 569 923 474 582 874 498 457 843 1127 1325 1113 1011 -8 -530 -133 -163 785 944 129 43 -36 227 83 -273 -319 -455 -103 -149 -1149 -1488 -1853 -1681 -945 -615 -367 -275 151 165 17 242 80 390 767 492 321 523 184 -458 -419 -426 -471 146 -22 -942 -654 -473 -278 256 260 102 40 2 -30 170 324 385 499 345 1 -22 368 310 590 707 290 760 925 332 133 -13 -273 -76 56 30 -263 83 93 -379 -297 -477 -725 -204 -511 -684 -890 -702 -127 284 474 224 -380 -622 -104 178 236 155 -30 -85 286 376 673 519 345 548 703 430 109 -62 -310 164 816 786 624 576 -423 -1334 -626 -352 -232 -50 -463 -975 -957 -743 -714 -594 -287 -526 -305 -314 141 770 568 489 796 421 510 768 438 412 744 1026 1233 1063 992 -8 -503 -122 -148 738 906 130 44 -37 230 81 -259 -288 -407 -92 -139 -1122 -1543 -2007 -1877 -1060 -714 -435 -334 182 197 19 267 84 407 823 540 366 627 224 -558 -500 -493 -542 171 -26 -1157 -822 -606 -372 349 358 141 54 3 -38 207 391 480 641 449 1 -29 484 401 741 865 352 914 1149 424 173 -18 -360 -103 78 43 -380 122 138 -557 -424 -680 -1023 SS 20250323T164659.4Z 9213.699299 324 1 2.88 2 39.02 132.59 73.01 221.90 0.00 1 0.00 1 0 17 7.557e-03 6.156e-03 6.435e-04 4.885e-04 1.758830e-01 2.741747e-04 1.975960e-03 -6.000000e+00 4.799282e-03 227.55 -2.00 3.25 -2.00 314.45 0.00e+00 3.130406e-04 2.234894e-05 1.582620e-05 -6.000000e+00 2.195025e-04 285.03 -2.00 20.00 -2.00 313.87 0.00e+00 1.286 0.000 302.00 328.00 3 1.0362e+00 6.9756e-04 1.5068e-02 -6.0000e+00 1.1885e-02 8.3261e-03 7.7134e-04 8.3063e-03 -6.0000e+00 1.2855e-02 -2.3216e-03 4.4175e-04 4.0665e-03 -6.0000e+00 7.6743e-03 -2.9382e-03 1.8555e-04 1.1462e-03 -6.0000e+00 3.1789e-03 4.5104e-02 2.1300e-04 1.7345e-05 2.0304e-05 -6.0000e+00 2.7287e-04 2.2221e-02 -2.4752e-05 12 1 1 12 1 1 99.11 28.09 0.32 0.02222 0.02382 114 211 1 5 0 24.970 36.00 20.00 28.09 31.32 0.0 971.60 -322 -1562 -1718 -2287 -1652 -324 670 1204 714 -849 -1451 -121 252 360 325 -50 -171 379 528 1383 1003 637 1104 1076 612 316 -94 -436 134 1399 1502 1076 1109 -557 -1968 -1178 -387 -339 -206 -579 -1310 -1142 -813 -895 -751 -398 -653 -494 -398 67 970 807 649 983 508 673 857 447 486 793 1013 1307 1090 1025 40 -659 -126 -50 680 951 157 49 -141 144 -33 -342 -247 -400 -161 -347 -1123 -1398 -1794 -1718 -991 -675 -382 -256 185 122 81 281 131 373 813 549 299 471 149 -415 -522 -412 -579 100 95 -884 -714 -399 -282 298 419 248 -64 70 -54 189 418 311 356 367 -16 -19 350 349 493 756 364 707 959 338 201 -113 -362 -110 141 5 -193 77 87 -384 -377 -445 -711 -128 -654 -710 -901 -642 -122 259 473 300 -373 -623 -54 114 179 168 -26 -94 213 291 771 568 365 641 620 365 191 -56 -257 75 793 867 623 661 -338 -1197 -725 -247 -229 -150 -443 -1057 -962 -678 -751 -626 -336 -539 -395 -322 54 800 677 553 866 448 602 770 402 435 715 916 1243 1064 1000 39 -621 -115 -46 632 927 157 50 -146 144 -33 -321 -226 -351 -145 -328 -1110 -1428 -1917 -1897 -1129 -796 -460 -309 222 144 94 307 140 394 857 607 344 558 184 -511 -628 -481 -657 115 113 -1096 -907 -517 -373 401 568 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