File name: Pandora257s1_AustinTX_20250326_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250327T064303.4Z 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 v1.8.75 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20250326_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: 20250326 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 20250326T143817.0Z 9216.609919 146 1 54.57 2 62.70 104.18 51.58 149.35 0.00 1 0.00 1 0 17 3.636e-02 9.083e-03 8.941e-03 2.282e-03 2.860092e-01 1.246250e-03 3.119051e-03 -6.000000e+00 2.310731e-02 227.77 -2.00 3.25 -2.00 317.79 0.00e+00 -3.891967e-04 2.162805e-04 2.129369e-04 -6.000000e+00 1.057045e-03 285.23 -2.00 20.00 -2.00 317.02 0.00e+00 2.168 0.000 302.00 328.00 3 5.4242e+00 3.3254e-03 2.5174e-02 -6.0000e+00 5.7251e-02 2.2294e-02 3.7521e-03 1.3660e-02 -6.0000e+00 6.1914e-02 1.4997e-02 2.2852e-03 6.6353e-03 -6.0000e+00 3.6960e-02 -1.2087e-02 1.1131e-03 1.8525e-03 -6.0000e+00 1.5302e-02 1.9636e-04 5.9389e-04 8.1506e-05 2.7401e-05 -6.0000e+00 1.3131e-03 2.4486e-02 4.5625e-06 11 8 0 10 0 0 100.00 27.77 0.17 0.02449 0.02895 141 14 1 5 0 387.000 35.75 20.00 27.77 27.65 0.0 945.83 -2532 -8478 -6925 -2192 -21372 -11866 -14668 -5253 -2234 -9327 5708 -7300 -4534 5718 2426 -3483 -1617 7044 4619 1229 10249 1506 8711 3480 1167 -5797 -3032 1379 -1680 2114 1363 -2626 -2718 2019 -4243 8141 -6165 110 -743 1131 -1557 447 2348 -2820 -342 -1634 -2058 1739 -651 449 1977 2962 -87 2851 -908 205 -201 382 818 1139 313 1234 3569 174 -1786 -1185 1314 1286 -679 1615 304 447 -711 443 369 138 757 -1421 -370 -1371 -1833 -1498 -2180 -1139 -42 -231 -28 -20 332 671 -792 -36 -466 712 442 1325 403 163 -375 -857 -475 -729 158 381 -132 -1282 -750 -2 -108 728 42 56 -6 491 20 108 596 107 507 28 -212 -454 491 1311 -314 268 521 346 971 228 -391 -834 -30 -130 -191 64 -347 522 807 80 -455 -695 -505 -199 -749 -604 -176 -1988 -1003 -1355 -483 -215 -1015 559 -876 -589 758 371 -614 -297 1241 867 246 1914 313 1743 770 276 -1498 -752 317 -387 472 322 -688 -749 539 -1204 2107 -2028 39 -311 478 -736 218 1157 -1480 -175 -842 -1050 844 -324 226 1027 1620 -52 1732 -593 136 -135 255 540 757 218 903 2713 142 -1477 -934 971 953 -544 1377 259 394 -632 375 318 109 554 -1037 -280 -1149 -1713 -1400 -2206 -1213 -47 -275 -35 -23 388 815 -915 -39 -467 695 454 1469 497 202 -487 -1109 -584 -918 190 466 -171 -1639 -1004 -2 -160 1126 64 85 -9 735 28 145 789 147 731 42 -331 -706 738 1879 -436 354 720 483 1301 326 -592 -1318 -48 -219 -313 109 -616 937 1446 142 -785 -1165 -834 SS 20250326T155242.4Z 9216.661602 205 1 6.57 2 47.66 117.60 45.97 171.58 0.00 1 0.00 1 0 17 7.374e-03 5.793e-03 1.748e-03 1.188e-03 1.987810e-01 6.653313e-04 2.211288e-03 -6.000000e+00 4.685656e-03 227.78 -2.00 3.25 -2.00 315.05 0.00e+00 3.754067e-04 6.030703e-05 2.337584e-05 -6.000000e+00 2.143851e-04 285.23 -2.00 20.00 -2.00 314.40 0.00e+00 1.482 0.000 302.00 328.00 3 3.3340e+00 1.7027e-03 1.7253e-02 -6.0000e+00 1.1609e-02 9.4303e-03 1.8862e-03 9.3714e-03 -6.0000e+00 1.2555e-02 -1.9605e-03 1.0777e-03 4.5791e-03 -6.0000e+00 7.4949e-03 -2.6607e-03 4.5919e-04 1.2936e-03 -6.0000e+00 3.1026e-03 3.5872e-03 2.5213e-04 4.2244e-05 2.2046e-05 -6.0000e+00 2.6631e-04 2.4694e-02 -2.5268e-05 12 1 1 12 1 1 99.36 27.96 0.36 0.02469 0.02659 24 20 1 5 0 262.700 36.00 20.00 27.96 29.99 0.0 962.32 -724 -1718 -1013 -2412 -2512 -508 841 640 -145 -799 -1025 -264 -29 729 556 -110 195 387 916 1281 1133 441 1114 1200 43 95 -292 -369 295 1226 1229 297 461 -496 -2135 -816 -784 -244 -47 -208 -1198 -870 -749 -820 -397 -472 -716 -419 -377 110 811 902 319 1039 422 624 692 473 660 800 1201 1430 1110 1056 -32 -734 -242 127 641 1065 119 83 -106 279 -47 -269 -395 -282 -78 -544 -1127 -1333 -1725 -1745 -986 -445 -309 -106 33 263 96 150 194 317 469 476 307 444 51 -432 -601 -343 -315 96 -167 -958 -683 -411 -141 434 342 67 29 -52 1 189 485 343 418 270 -101 -46 430 376 415 721 227 625 999 359 -33 -191 -118 -116 67 13 -32 37 140 -277 -300 -444 -781 -232 -580 -336 -771 -760 -160 253 208 -51 -290 -382 -96 -11 295 246 -52 91 186 449 639 573 227 582 612 23 51 -154 -198 151 614 631 161 244 -266 -1152 -445 -466 -156 -31 -149 -936 -679 -597 -659 -317 -372 -553 -329 -292 85 646 721 269 865 363 545 609 416 577 705 1048 1316 1039 1016 -30 -696 -216 112 590 1017 118 85 -110 277 -45 -249 -352 -242 -69 -504 -1108 -1377 -1844 -1912 -1141 -526 -370 -130 41 318 109 167 209 333 508 537 353 533 64 -539 -717 -400 -368 114 -204 -1203 -870 -546 -190 591 480 94 39 -69 2 233 591 432 539 357 -138 -62 571 496 538 917 280 768 1267 465 -44 -260 -160 -162 95 19 -48 56 208 -419 -441 -655 -1142 SS 20250326T155627.5Z 9216.664208 208 1 4.86 2 46.94 118.42 45.84 172.81 0.00 1 0.00 1 0 17 7.828e-03 6.099e-03 9.893e-04 7.009e-04 1.959355e-01 3.926030e-04 2.186379e-03 -6.000000e+00 4.973821e-03 227.78 -2.00 3.25 -2.00 314.85 0.00e+00 3.551926e-04 3.437340e-05 2.045643e-05 -6.000000e+00 2.275710e-04 285.23 -2.00 20.00 -2.00 314.22 0.00e+00 1.462 0.000 302.00 328.00 3 2.0555e+00 1.0027e-03 1.7023e-02 -6.0000e+00 1.2323e-02 1.1686e-02 1.1108e-03 9.2492e-03 -6.0000e+00 1.3328e-02 -2.6027e-03 6.3450e-04 4.5192e-03 -6.0000e+00 7.9559e-03 -2.5734e-03 2.6892e-04 1.2753e-03 -6.0000e+00 3.2934e-03 1.3196e-02 2.4293e-04 2.4869e-05 2.1818e-05 -6.0000e+00 2.8269e-04 2.4586e-02 -2.9802e-05 12 1 1 12 1 1 99.72 27.97 0.30 0.02459 0.02641 68 75 1 5 0 70.300 36.00 19.99 27.97 30.23 0.0 965.43 -946 -1564 -1759 -2651 -1910 -378 479 651 487 -1217 -1623 -297 441 452 299 -111 -273 832 947 1360 1098 713 1181 1293 676 463 -147 -414 43 1270 1338 983 857 -660 -2260 -1034 -717 -281 -57 -510 -1065 -1056 -743 -924 -558 -303 -813 -353 -285 80 893 836 756 886 516 513 773 285 552 890 1014 1335 1324 870 103 -717 -368 -112 910 916 194 19 -63 -24 -30 -166 -208 -568 -203 -403 -1196 -1437 -1916 -1801 -940 -732 -312 -162 116 190 126 269 -39 373 782 606 231 442 194 -494 -341 -404 -387 108 -174 -896 -671 -418 -185 409 398 107 12 102 -65 213 416 325 391 384 -19 -33 338 360 470 669 332 687 945 359 156 -177 -302 -132 124 -43 -248 135 129 -447 -346 -378 -681 -322 -558 -622 -955 -645 -124 162 237 178 -468 -641 -115 184 197 143 -54 -138 430 478 698 572 377 635 718 372 258 -80 -228 23 652 704 542 490 -367 -1262 -583 -421 -180 -41 -376 -823 -855 -592 -743 -445 -247 -650 -274 -225 63 701 690 631 768 445 450 682 252 485 787 896 1242 1259 828 100 -665 -332 -103 841 889 197 19 -64 -24 -29 -154 -185 -506 -179 -375 -1192 -1470 -2046 -1981 -1062 -853 -370 -196 140 227 144 299 -42 387 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