File name: Pandora257s1_AustinTX_20250403_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250404T064056.6Z 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_20250403_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: 20250403 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 20250403T151208.1Z 9224.633427 136 1 54.82 2 53.44 106.99 100.54 48.65 0.00 1 0.00 1 0 17 9.524e-02 3.233e-02 1.793e-02 6.321e-03 1.769231e-01 3.431816e-03 1.938070e-03 -6.000000e+00 6.065883e-02 228.38 -2.00 3.25 -2.00 317.00 0.00e+00 4.222329e-04 4.848253e-04 1.436137e-04 -6.000000e+00 2.774941e-03 285.78 -2.00 20.00 -2.00 316.20 0.00e+00 1.675 0.000 302.00 328.00 3 7.4449e+00 9.0116e-03 1.8334e-02 -6.0000e+00 1.5048e-01 -2.8085e-02 1.0142e-02 8.4452e-03 -6.0000e+00 1.6265e-01 7.0475e-02 5.9480e-03 4.0992e-03 -6.0000e+00 9.7075e-02 -3.3916e-02 2.7508e-03 1.1538e-03 -6.0000e+00 4.0174e-02 5.0699e-05 1.0445e-03 2.2624e-04 1.7480e-05 -6.0000e+00 3.4400e-03 2.0619e-02 -1.2269e-04 12 9 8 11 32 0 99.90 28.02 -3.51 0.02062 0.02847 35 3 1 5 0 1565.910 36.00 20.00 28.02 31.08 0.0 971.79 -1222 -6711 3891 44614 -8060 -10225 -11652 -7200 -4702 -3959 -42560 -10981 1931 30592 29593 -117 3962 25879 -18161 6734 31950 700 28601 15809 4439 -6129 -6998 8231 -4691 3308 328 6193 -10313 5907 -9223 34626 -15826 -2328 1361 4189 2170 6205 7374 -6127 -568 -7801 -5180 3953 2049 3485 3947 -10696 -579 6493 -4549 -1137 -1431 802 2302 1135 -931 618 11419 37 -4669 -387 6285 2710 -1286 3242 -359 3763 -892 638 105 824 3555 -7191 -1305 -2902 -4208 -1309 -4202 -2001 3278 -990 359 1627 1897 2402 -3553 -2417 732 -84 -901 4264 1896 -3871 -179 -718 -906 -1551 2985 -729 1414 -2313 -843 2324 641 4264 204 485 -277 2425 1195 -1274 -901 -2221 -1479 -1528 547 -1574 1945 5363 -2559 -3431 659 -602 632 -660 -828 -1594 2376 971 -1863 831 -168 2390 3315 -2060 -393 -2509 420 -160 -970 502 3650 -1062 -1364 -1659 -1061 -722 -626 -10161 -2012 373 4903 5236 -30 1009 5472 -5588 1822 6835 208 6577 4288 1396 -2165 -2446 2370 -1478 952 100 1859 -3777 1846 -3326 8282 -6878 -1015 659 2216 1266 3642 4382 -4204 -368 -5372 -3397 2308 1200 2028 2368 -7800 -400 4339 -3486 -857 -1091 598 1687 853 -742 513 8954 33 -4318 -324 4661 2062 -1069 2794 -344 3586 -890 606 94 671 2599 -5648 -997 -2442 -3938 -1293 -4565 -2257 3734 -1138 427 1959 2268 2752 -4437 -2746 750 -84 -942 4561 2265 -4797 -222 -973 -1175 -1917 3436 -892 1792 -3216 -1102 3079 902 6048 311 733 -406 3565 1652 -1712 -1195 -3092 -2164 -2363 775 -2282 2931 7508 -3690 -4757 847 -782 839 -930 -1217 -2426 3560 1528 -2870 1304 -274 3897 5387 -3483 -638 -4056 718 SS 20250403T151618.6Z 9224.636327 139 1 54.68 2 52.58 107.72 99.89 49.24 0.00 1 0.00 1 0 17 7.761e-03 5.981e-03 3.053e-04 2.059e-04 2.048417e-01 1.152276e-04 2.281670e-03 -6.000000e+00 4.942897e-03 228.38 -2.00 3.25 -2.00 315.11 0.00e+00 3.937400e-04 1.057849e-05 2.323981e-05 -6.000000e+00 2.261344e-04 285.78 -2.00 20.00 -2.00 314.44 0.00e+00 1.642 0.000 302.00 328.00 3 1.8503e+00 2.9525e-04 1.8739e-02 -6.0000e+00 1.2262e-02 -2.2563e-03 3.2726e-04 9.7167e-03 -6.0000e+00 1.3254e-02 -1.2104e-03 1.8678e-04 4.7302e-03 -6.0000e+00 7.9107e-03 -3.1564e-03 7.9689e-05 1.3345e-03 -6.0000e+00 3.2731e-03 1.3517e-02 2.5257e-04 7.2986e-06 2.2652e-05 -6.0000e+00 2.8034e-04 2.3697e-02 -3.7887e-05 10 0 0 10 0 0 99.93 28.02 0.31 0.02370 0.02559 951 92 1 5 0 57.490 36.00 20.00 28.02 31.64 0.0 976.67 -673 -1527 -2005 -2785 -1989 -556 162 759 245 -987 -1605 -484 289 407 492 -28 -10 540 652 1242 996 554 1198 1135 666 339 -189 -307 266 1301 1373 1005 944 -765 -2169 -988 -606 -377 -98 -554 -1219 -934 -745 -819 -576 -372 -698 -369 -232 155 945 914 719 970 511 614 833 479 486 762 1138 1360 1220 1011 -35 -577 -141 20 764 964 166 -67 -97 103 -40 -289 -231 -463 -134 -394 -1176 -1457 -1894 -1694 -939 -649 -363 -162 140 113 61 230 101 413 803 534 294 510 118 -502 -489 -464 -507 85 -49 -916 -689 -381 -190 281 351 137 42 54 -29 223 425 356 401 337 -52 -60 381 337 465 698 396 747 964 303 156 -111 -284 -63 95 -10 -236 91 90 -407 -328 -401 -691 -218 -489 -640 -909 -610 -165 50 252 82 -345 -579 -182 110 172 215 -12 -5 258 320 620 481 272 597 586 357 184 -101 -158 137 660 716 523 510 -422 -1203 -555 -353 -239 -66 -402 -926 -714 -582 -646 -452 -288 -530 -284 -175 118 739 724 577 808 439 518 708 408 412 651 1004 1224 1123 960 -33 -537 -128 18 692 914 165 -68 -100 102 -39 -264 -202 -406 -121 -362 -1158 -1519 -1997 -1892 -1077 -766 -436 -194 171 133 69 255 108 440 855 598 341 620 146 -620 -593 -546 -596 99 -59 -1136 -874 -505 -257 386 486 191 58 72 -38 282 531 448 520 450 -72 -83 512 448 603 885 486 938 1220 396 207 -152 -392 -88 138 -15 -354 139 136 -621 -487 -594 -1013 SS 20250403T154622.6Z 9224.657206 158 1 54.66 2 46.49 113.45 95.04 53.31 0.00 1 0.00 1 0 17 8.857e-03 6.202e-03 1.533e-03 8.987e-04 1.810404e-01 4.976378e-04 2.013716e-03 -6.000000e+00 5.641663e-03 228.38 -2.00 3.25 -2.00 315.66 0.00e+00 1.584063e-04 5.112503e-05 5.152406e-05 -6.000000e+00 2.580594e-04 285.78 -2.00 20.00 -2.00 314.95 0.00e+00 1.450 0.000 302.00 328.00 3 4.7232e+00 1.2829e-03 1.6563e-02 -6.0000e+00 1.3996e-02 1.0498e-02 1.4278e-03 8.5922e-03 -6.0000e+00 1.5127e-02 4.7778e-03 8.1422e-04 4.1886e-03 -6.0000e+00 9.0287e-03 -6.0279e-03 3.5352e-04 1.1606e-03 -6.0000e+00 3.7362e-03 9.5453e-04 3.7290e-04 3.1987e-05 1.9578e-05 -6.0000e+00 3.1991e-04 2.3135e-02 -2.0371e-05 10 0 0 10 0 0 100.00 28.10 0.31 0.02314 0.02594 542 52 1 5 0 100.840 36.00 20.00 28.10 32.66 0.0 980.99 -813 -1403 -3407 -2501 -2732 -1266 284 728 585 -1850 -589 -1151 105 1502 466 -168 36 701 700 1187 1700 -166 2209 1162 601 -70 -329 -359 377 1044 1015 595 530 -839 -2522 189 -1503 -413 -163 -384 -1386 -913 -151 -1170 -685 -960 -724 -279 -390 86 1029 1453 612 1284 315 465 813 583 477 690 1008 1350 1691 773 -186 -552 172 328 558 885 170 103 -206 353 317 -208 -133 -645 -242 -484 -1326 -1321 -2237 -1563 -560 -713 -333 -207 404 249 -275 74 -174 434 948 617 222 394 87 -647 -477 -601 -399 -7 16 -1078 -577 -189 -151 348 316 196 94 57 -94 65 409 280 356 150 0 -178 430 534 396 624 355 695 945 127 272 -168 -162 -232 140 125 -301 301 253 -345 -347 -518 -712 -213 -349 -852 -647 -669 -300 69 190 163 -546 -175 -360 32 494 169 -65 15 288 295 508 733 -74 977 537 288 -34 -157 -164 163 442 439 269 248 -399 -1204 90 -792 -225 -102 -270 -984 -675 -113 -892 -518 -717 -526 -196 -292 64 789 1073 477 1032 262 393 689 494 403 589 886 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