File name: Pandora257s1_AustinTX_20250108_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250110T041316.4Z 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 v1.8.60 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20250108_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: 20250108 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 20250108T173920.1Z 9139.735649 248 1 54.11 2 54.22 163.21 107.17 56.61 0.00 1 0.00 1 0 17 2.208e-02 9.237e-03 4.375e-03 1.980e-03 2.155584e-01 1.077969e-03 2.413731e-03 -6.000000e+00 1.384113e-02 224.22 -2.00 3.25 -2.00 316.44 0.00e+00 2.313075e-04 1.326607e-04 4.164286e-05 -6.000000e+00 6.381730e-04 283.80 -2.00 20.00 -2.00 315.72 0.00e+00 1.706 0.000 302.00 328.00 3 5.8576e+00 2.7898e-03 1.9411e-02 -6.0000e+00 3.4027e-02 3.3910e-02 3.1252e-03 1.0102e-02 -6.0000e+00 3.6903e-02 1.2298e-02 1.8015e-03 4.9876e-03 -6.0000e+00 2.2072e-02 -1.2018e-02 8.1803e-04 1.4270e-03 -6.0000e+00 9.1856e-03 2.2340e-04 2.4130e-04 7.1066e-05 2.2939e-05 -6.0000e+00 7.9638e-04 2.4778e-02 -8.7520e-05 11 9 0 11 32 0 99.99 25.15 0.47 0.02478 0.02659 33 3 1 5 0 1639.350 34.00 20.17 25.15 9.85 0.7 813.41 -8105 -9046 -1911 413 -2968 -10497 -3941 -3191 2662 -4965 3574 -1504 1824 6728 5505 -628 -2353 4350 1312 4586 3579 -786 1687 3469 16 -1485 -2419 1248 -1272 1187 -508 928 -1003 1358 -4008 4441 -4641 -2152 425 -677 652 44 729 -1292 -1914 -673 -3022 1747 -218 300 541 2365 4 1544 -33 -396 -252 765 244 1764 677 2021 2675 1121 -1332 -258 615 56 897 1098 -559 437 -662 76 -125 446 -299 -1427 -682 -713 -2359 -1467 -2382 -1873 -102 -475 -640 164 690 446 189 -334 24 204 879 1501 1282 371 -73 -665 -285 -383 -217 68 -32 -417 -932 -396 -1 417 781 109 -130 552 -292 550 175 -197 -421 -206 -186 -481 544 858 -265 326 398 709 1338 -256 -249 -679 348 552 -76 -279 -450 543 423 -87 -399 -636 -260 -1468 -1730 -337 68 -479 -1804 -666 -579 486 -1017 692 -324 415 1622 1475 -192 -764 1368 438 1516 1213 -282 604 1268 6 -597 -962 459 -462 418 -188 355 -406 540 -1667 1741 -1983 -1028 228 -414 425 30 509 -928 -1380 -474 -2133 1150 -144 200 374 1688 3 1112 -25 -304 -195 584 186 1341 539 1679 2332 1021 -1224 -223 500 45 759 1005 -558 447 -684 75 -115 376 -235 -1195 -538 -612 -2267 -1521 -2462 -2043 -116 -578 -815 198 885 552 219 -359 26 215 955 1616 1514 477 -91 -826 -362 -461 -253 81 -39 -554 -1212 -537 -2 617 1190 168 -194 767 -381 726 230 -267 -563 -290 -268 -696 760 1150 -368 429 506 899 1753 -359 -338 -956 497 816 -119 -456 -708 864 676 -137 -661 -1025 -412 SS 20250108T174418.6Z 9139.739104 251 1 53.73 2 53.92 164.59 106.30 57.36 0.00 1 0.00 1 0 17 3.590e-02 1.249e-02 6.194e-03 2.645e-03 2.082786e-01 1.430322e-03 2.334361e-03 -6.000000e+00 2.253181e-02 224.22 -2.00 3.25 -2.00 316.63 0.00e+00 8.320308e-04 1.864108e-04 6.961394e-05 -6.000000e+00 1.037581e-03 283.80 -2.00 20.00 -2.00 315.92 0.00e+00 1.694 0.000 302.00 328.00 3 6.2885e+00 3.7117e-03 1.9159e-02 -6.0000e+00 5.5395e-02 2.7517e-02 4.1660e-03 9.8964e-03 -6.0000e+00 6.0054e-02 2.2202e-02 2.4061e-03 4.8445e-03 -6.0000e+00 3.5920e-02 -1.3476e-02 1.1059e-03 1.5784e-03 -6.0000e+00 1.4966e-02 1.4828e-04 1.5584e-03 9.4788e-05 2.3311e-05 -6.0000e+00 1.2950e-03 2.2590e-02 1.2126e-04 12 9 8 11 8 0 99.96 25.16 0.67 0.02259 0.03430 23 2 1 5 0 2335.590 34.00 20.28 25.16 10.09 0.7 814.89 -8726 -8242 -1533 8502 -24342 -10774 132 -4113 8164 -3960 6925 -3243 3458 8650 7592 -1201 -4074 7620 2580 6020 6450 -1530 2753 3425 -683 -1212 -3191 2408 -2028 984 -1582 2606 -2546 3548 -5271 9121 -5457 -2174 817 -1120 1588 374 654 -1436 -2411 -687 -3954 2540 351 26 437 3390 -935 1580 -411 -1405 -413 332 -289 1934 133 2339 3440 1776 -1741 17 517 -203 942 872 -741 1084 -1140 20 265 918 -446 -2385 -892 -1330 -2843 -1880 -2392 -1643 256 -438 -746 229 668 1109 137 -902 -577 152 757 2019 1727 601 279 -603 -109 -938 30 -464 213 -908 -631 109 216 750 944 546 -299 1314 -493 305 -35 -591 -885 -295 -357 -649 579 1151 -640 -69 358 358 1572 -328 -299 -953 889 303 -428 -184 -298 541 728 235 -344 -892 -334 -1504 -1480 -255 1222 -4603 -1754 20 -707 1323 -751 1211 -663 724 1915 1866 -345 -1263 2176 798 1842 1993 -518 913 1168 -251 -452 -1190 816 -692 324 -551 915 -977 1288 -2071 3181 -2407 -1063 406 -638 952 238 425 -961 -1626 -451 -2625 1545 215 16 281 2226 -672 1152 -314 -1102 -323 257 -224 1484 108 1962 3015 1628 -1626 15 425 -167 804 807 -684 1019 -1094 19 246 776 -353 -1865 -711 -1159 -2765 -1807 -2472 -1787 291 -531 -951 296 857 1363 158 -973 -578 162 826 2155 2023 768 372 -802 -137 -1129 34 -551 265 -1207 -879 145 302 1094 1418 824 -439 1782 -686 399 -46 -800 -1270 -409 -509 -926 797 1641 -884 -91 451 451 2033 -455 -432 -1430 1342 440 -656 -294 -492 902 1218 389 -557 -1413 -520 SS 20250108T184756.2Z 9139.783289 291 1 55.14 2 52.41 182.92 94.52 65.97 0.00 1 0.00 1 0 17 1.581e-02 7.476e-03 2.263e-03 1.227e-03 2.067710e-01 6.718152e-04 2.322626e-03 -6.000000e+00 9.913578e-03 224.22 -2.00 3.25 -2.00 315.87 0.00e+00 2.922205e-04 7.349531e-05 3.275300e-05 -6.000000e+00 4.569162e-04 283.80 -2.00 20.00 -2.00 315.20 0.00e+00 1.635 0.000 302.00 328.00 3 5.2154e+00 1.7234e-03 1.8611e-02 -6.0000e+00 2.4372e-02 2.4284e-02 1.9244e-03 9.6809e-03 -6.0000e+00 2.6429e-02 6.0907e-03 1.1021e-03 4.7767e-03 -6.0000e+00 1.5808e-02 -6.5878e-03 4.8840e-04 1.3667e-03 -6.0000e+00 6.5807e-03 4.6399e-04 5.6141e-04 4.3743e-05 2.2578e-05 -6.0000e+00 5.7022e-04 2.3837e-02 -4.0261e-05 11 9 0 11 40 0 99.93 25.33 0.31 0.02384 0.02806 30 3 1 5 0 1837.770 34.25 19.84 25.33 10.83 0.6 820.09 -4410 -4797 -1680 -353 -10377 -5051 -518 -738 2251 -2347 1706 -164 1327 4924 2765 -769 -1100 2927 1247 2405 2794 255 1228 839 52 -224 -1314 731 -657 947 171 1140 -473 216 -3242 2577 -2504 -1082 639 -786 -1906 -617 -153 -643 -1213 -662 -2040 356 -184 234 744 1886 409 1184 226 213 226 253 523 1294 959 1560 1858 1082 -329 -565 -105 -348 905 1152 -260 562 197 48 -114 254 -182 -1009 -346 -663 -1880 -1539 -1716 -1831 -378 -432 -511 -180 180 2 1 90 74 508 1018 1142 343 345 -66 -528 -353 -402 -273 -156 132 -614 -666 -264 -157 351 435 314 17 184 -60 487 343 93 -58 -90 -212 -420 560 449 93 697 438 740 1274 -41 -192 -495 -302 394 224 -119 -350 241 346 -184 -391 -568 -409 -960 -1094 -368 -80 -2231 -1117 -115 -177 558 -574 411 -43 369 1465 921 -283 -425 1122 500 975 1144 108 528 344 22 -97 -563 321 -281 395 74 512 -224 102 -1440 1207 -1236 -603 373 -522 -1385 -463 -108 -462 -875 -505 -1544 257 -132 168 552 1455 311 931 184 176 189 210 433 1073 827 1414 1654 997 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