File name: Pandora257s1_AustinTX_20250720_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250721T064403.5Z 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_20250720_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: 20250720 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 20250720T160341.6Z 9332.669232 349 1 8.47 2 35.88 96.51 19.86 261.66 0.00 1 0.00 1 0 17 1.387e-02 8.627e-03 6.573e-03 4.232e-03 1.602141e-01 2.374939e-03 1.748722e-03 -6.000000e+00 8.879868e-03 230.06 -2.00 3.25 -2.00 315.20 0.00e+00 3.084195e-04 2.299777e-04 2.175122e-05 -6.000000e+00 4.167024e-04 293.19 -2.00 20.00 -2.00 314.44 0.00e+00 1.233 0.000 302.00 328.00 3 5.7773e+00 6.1149e-03 1.4252e-02 -6.0000e+00 2.2060e-02 6.7485e-03 6.7800e-03 7.5979e-03 -6.0000e+00 2.3790e-02 1.4781e-02 3.8585e-03 3.6708e-03 -6.0000e+00 1.4246e-02 -1.0632e-02 1.6588e-03 1.0252e-03 -6.0000e+00 5.9185e-03 4.2549e-04 2.4786e-04 1.5084e-04 1.7032e-05 -6.0000e+00 5.0138e-04 2.7568e-02 -8.4900e-05 12 9 1 12 1 1 999.00 28.53 0.63 0.02757 0.02943 2 2 1 5 0 2820.840 36.25 20.00 28.53 34.94 0.0 994.99 -3099 -1903 -1146 3303 -4658 -5258 879 370 -1516 -1640 -3584 -68 2546 90 1363 -2217 778 2712 932 1731 2971 -71 2272 2365 247 -2018 -1443 -222 -88 626 3661 1175 145 -2987 -4165 2927 -1464 -854 -1310 -383 1422 -735 -636 -672 -683 -14 -1878 -329 -328 272 829 1311 442 1797 -724 1139 482 619 1409 1131 185 1863 1235 1253 -1217 -717 -563 152 519 462 -682 430 124 136 -34 -303 -4 -1708 -23 -762 -1596 -1284 -2445 -918 105 -880 -45 -268 -130 214 -148 711 672 700 -20 967 493 -239 -720 -677 -817 -379 324 1101 -101 -1060 -444 285 -69 950 598 -207 846 315 132 -275 -48 -82 894 -136 -365 -618 562 716 -593 605 744 416 641 -707 -204 -584 373 925 -161 -15 -310 416 576 154 -544 -892 -619 -921 -578 -339 885 -1274 -1422 257 106 -470 -524 -1189 -23 891 36 572 -1020 360 1262 452 849 1456 -36 1153 1134 125 -1046 -725 -115 -43 301 1736 593 76 -1610 -2242 1503 -786 -521 -922 -276 1082 -596 -526 -559 -565 -12 -1507 -252 -246 203 635 1045 371 1540 -605 1021 406 559 1260 1026 163 1700 1190 1234 -1198 -661 -489 139 460 443 -708 457 132 140 -33 -289 -3 -1463 -20 -717 -1541 -1339 -2569 -1007 121 -1091 -54 -333 -161 253 -175 765 719 726 -21 1032 575 -302 -889 -826 -1016 -445 368 1272 -124 -1312 -572 382 -97 1290 837 -291 1200 421 164 -346 -59 -105 1129 -183 -509 -865 761 931 -792 760 900 502 799 -933 -261 -769 497 1267 -233 -21 -457 623 866 229 -796 -1278 -929 SS 20250720T161234.7Z 9332.675402 355 1 53.02 2 33.98 97.98 21.71 263.43 0.00 1 0.00 1 0 17 1.630e-02 1.027e-02 3.418e-03 2.095e-03 1.530493e-01 1.167958e-03 1.653474e-03 -6.000000e+00 1.043566e-02 230.06 -2.00 3.25 -2.00 315.49 0.00e+00 1.523188e-04 1.195515e-04 2.136245e-05 -6.000000e+00 4.895694e-04 293.19 -2.00 20.00 -2.00 314.70 0.00e+00 1.205 0.000 302.00 328.00 3 6.4513e+00 3.0165e-03 1.3818e-02 -6.0000e+00 2.5926e-02 2.1005e-03 3.3493e-03 7.2241e-03 -6.0000e+00 2.7957e-02 2.6202e-02 1.9061e-03 3.4853e-03 -6.0000e+00 1.6741e-02 -1.2862e-02 8.2284e-04 9.5859e-04 -6.0000e+00 6.9567e-03 2.2571e-04 9.2993e-04 7.4990e-05 1.5458e-05 -6.0000e+00 5.8908e-04 2.7458e-02 -3.0456e-05 12 8 8 10 0 0 96.74 28.55 0.37 0.02746 0.03445 15 1 1 5 0 3534.080 36.25 20.00 28.55 35.19 0.0 997.36 -994 -2758 -1637 4444 -6630 -3516 -3325 -2186 -363 -52 -2390 -3519 -66 2038 2258 -1700 -508 3400 1276 1657 5984 -892 3380 1599 1967 -1645 -684 -84 -617 318 1347 331 -1321 -929 -5221 2839 -3432 -927 -990 -615 1835 -244 274 -1092 -372 -1827 -2298 -6 -458 -81 1769 2714 315 1697 125 534 248 -95 750 514 914 1224 2945 962 -1702 -1436 543 427 217 1256 132 964 -191 169 -272 593 289 -3060 -908 -866 -1923 -1326 -3050 -1696 -101 -728 45 501 452 493 -292 -469 345 -154 234 1563 726 497 -631 -28 149 -1234 69 210 -45 -636 -541 83 -262 1286 739 206 -101 537 -182 -430 97 -224 -84 -130 -88 -788 989 1395 -430 571 694 380 661 -218 -750 -696 372 -50 -152 -42 -215 511 1131 847 -629 -1416 -589 -275 -801 -461 1114 -1752 -886 -875 -612 -106 -15 -744 -1153 -23 743 887 -733 -224 1477 580 764 2674 -392 1595 721 910 -793 -318 -41 -287 144 613 157 -656 -458 -2651 1363 -1743 -525 -645 -446 1395 -181 207 -838 -281 -1380 -1852 -5 -343 -60 1340 2128 264 1450 102 440 206 -79 616 429 786 1106 2743 932 -1650 -1304 456 386 189 1170 133 998 -200 170 -257 554 250 -2628 -784 -808 -1817 -1349 -3365 -1956 -113 -868 56 633 568 596 -332 -531 359 -156 243 1723 878 597 -794 -35 175 -1510 81 254 -54 -800 -713 114 -375 1883 1036 289 -147 722 -228 -556 124 -274 -109 -178 -124 -1120 1350 1823 -543 736 861 472 845 -270 -972 -924 499 -70 -221 -64 -339 757 1675 1336 -983 -2176 -889 SS 20250720T163116.2Z 9332.688382 361 1 17.43 2 30.00 101.42 25.62 266.57 0.00 1 0.00 1 0 17 7.620e-03 6.052e-03 1.664e-03 1.243e-03 1.526527e-01 7.036625e-04 1.693742e-03 -6.000000e+00 4.879131e-03 230.06 -2.00 3.25 -2.00 314.53 0.00e+00 3.226991e-04 5.936997e-05 1.873210e-05 -6.000000e+00 2.289287e-04 293.19 -2.00 20.00 -2.00 313.82 0.00e+00 1.154 0.000 302.00 328.00 3 4.6867e+00 1.8017e-03 1.3434e-02 -6.0000e+00 1.2121e-02 5.4923e-03 1.9886e-03 7.2814e-03 -6.0000e+00 1.3071e-02 3.4596e-03 1.1373e-03 3.5264e-03 -6.0000e+00 7.8273e-03 -4.9539e-03 4.7913e-04 9.9133e-04 -6.0000e+00 3.2522e-03 1.3941e-03 2.5587e-04 4.4252e-05 1.7560e-05 -6.0000e+00 2.7546e-04 2.8101e-02 -3.8715e-05 12 1 1 12 1 1 85.08 28.57 0.30 0.02810 0.03002 18 6 1 5 0 916.860 36.50 20.00 28.57 35.83 0.0 1001.07 -184 -1601 -2090 -1123 -2500 -792 666 1066 378 -698 -1279 -592 332 513 1549 -172 -428 980 736 1262 1366 365 1073 1380 949 -139 -398 -108 -401 978 1205 595 363 -748 -2394 -343 -691 -421 -271 -455 -744 -905 -615 -1161 -549 -468 -1077 -455 -343 181 1019 1376 453 474 546 562 648 236 395 739 1130 1259 1360 860 -129 -706 -245 -10 772 868 177 -83 25 202 48 89 96 -665 -290 -245 -1265 -1319 -1767 -1630 -764 -545 -329 41 51 57 115 325 46 545 685 728 338 293 48 -354 -312 -600 -276 291 1 -868 -806 -344 -357 292 348 60 181 -5 -137 1 271 371 293 385 -231 -235 351 543 365 617 426 788 873 167 56 -146 -146 99 65 -126 -86 160 227 -201 -357 -524 -781 -71 -648 -834 -419 -889 -294 254 401 152 -291 -544 -260 155 242 781 -93 -224 518 398 692 756 206 610 806 572 -85 -238 -62 -233 550 686 329 207 -429 -1375 -197 -435 -283 -196 -348 -614 -780 -539 -974 -480 -403 -906 -369 -271 142 818 1150 398 408 481 501 581 212 353 666 1049 1230 1323 858 -127 -691 -225 -9 721 832 183 -85 26 208 47 83 87 -583 -259 -225 -1279 -1374 -1877 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