File name: Pandora85s1_NewOrleansLA-XULA_20250905_L2Fit_fout2c5d20250716p1-8.txt File generation date: 20260326T091949.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Morewell Gasseller Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 85 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora85_OF_v3d20231120.txt Instrument calibration file used: Pandora85s1_CF_v5d20250716.txt Level 1 file used: Pandora85s1_NewOrleansLA-XULA_20250905_L1_smca1c5d20250716p1-8.txt Full location name: Xavier University of Louisiana Short location name: NewOrleansLA-XULA Country of location: United States Location latitude [deg]: 29.9643 Location longitude [deg]: -90.1074 Location altitude [m]: 10 Local noon date: 20250905 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0150 305.1556 305.2961 305.4367 305.5772 305.7178 305.8583 305.9988 306.1393 306.2798 306.4203 306.5608 306.7012 306.8417 306.9821 307.1226 307.2630 307.4034 307.5438 307.6842 307.8245 307.9649 308.1052 308.2456 308.3859 308.5262 308.6665 308.8068 308.9471 309.0874 309.2276 309.3679 309.5081 309.6484 309.7886 309.9288 310.0690 310.2091 310.3493 310.4895 310.6296 310.7698 310.9099 311.0500 311.1901 311.3302 311.4703 311.6104 311.7504 311.8905 312.0305 312.1705 312.3105 312.4505 312.5905 312.7305 312.8705 313.0104 313.1504 313.2903 313.4302 313.5702 313.7101 313.8499 313.9898 314.1297 314.2695 314.4094 314.5492 314.6891 314.8289 314.9687 315.1085 315.2482 315.3880 315.5278 315.6675 315.8072 315.9469 316.0867 316.2264 316.3660 316.5057 316.6454 316.7850 316.9247 317.0643 317.2039 317.3435 317.4831 317.6227 317.7623 317.9019 318.0414 318.1809 318.3205 318.4600 318.5995 318.7390 318.8785 319.0179 319.1574 319.2969 319.4363 319.5757 319.7151 319.8545 319.9939 320.1333 320.2727 320.4120 320.5514 320.6907 320.8300 320.9694 321.1087 321.2479 321.3872 321.5265 321.6657 321.8050 321.9442 322.0834 322.2227 322.3619 322.5010 322.6402 322.7794 322.9185 323.0577 323.1968 323.3359 323.4750 323.6141 323.7532 323.8923 324.0313 324.1704 324.3094 324.4484 324.5875 324.7265 324.8655 --------------------------------------------------------------------------------------- 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 20250905T122314.5Z 9379.516140 162 1 54.20 2 81.49 87.26 128.33 267.71 0.00 1 0.00 1 0 17 5.105e-01 2.497e-02 3.543e-01 1.175e-02 6.718066e-01 6.695622e-03 8.597444e-03 -6.000000e+00 2.983006e-01 228.89 -2.00 3.24 -2.00 321.81 0.00e+00 6.260229e-03 3.843266e-03 1.240031e-02 -6.000000e+00 1.395333e-02 293.91 -2.00 20.00 -2.00 321.21 0.00e+00 6.355 0.003 302.00 328.00 3 2.0576e+00 2.6922e-02 9.8701e-02 -6.0000e+00 7.3954e-01 5.0290e-01 3.5083e-02 9.2714e-02 -6.0000e+00 7.9795e-01 -8.0500e-01 2.7530e-02 2.6187e-02 -6.0000e+00 4.7827e-01 3.2966e-01 1.3177e-02 8.7069e-03 -6.0000e+00 2.0722e-01 6.3644e-05 2.1523e-04 3.5716e-04 1.4420e-04 -6.0000e+00 1.4430e-02 1.7843e-02 0.0000e+00 12 9 8 11 4 0 2.40 32.52 0.64 0.01784 0.01946 38 4 1 5 0 1426.140 40.50 20.00 32.52 32.52 4.1 1031.70 -32272 -84809 -44686 6811 900000 -183296 -114181 -22030 -135775 -2732 22567 -15872 63862 -74583 -66472 233094 -95277 10421 15491 -81218 -26982 -181 900000 900000 -53548 72243 189778 -22852 10130 -5943 55275 124506 24455 -34534 17851 43507 48586 -19458 14840 23085 44570 128962 61185 26580 42419 261152 13799 90708 49557 28146 38309 30980 19162 11626 12016 26181 13376 19282 10005 -632 3727 13649 28775 19102 19182 35400 6105 6805 1921 12480 20752 9623 10422 13213 -5853 9786 9580 -7534 -6488 -4399 -366 4491 -4104 -5728 -1355 -4193 1373 651 2430 -323 1605 3737 -1455 -8531 -11474 -4737 -1229 -407 -1107 -2635 1879 -4850 -4703 -4650 -1154 -830 -4288 -252 -279 1079 733 2019 -1795 -114 790 -1509 -802 1414 -299 1189 2316 245 1852 3195 2055 1332 -970 1334 -788 -1012 964 -187 85 -27 508 -135 -446 1141 1207 -1234 -143 -361 -1895 -369 -1861 -682 78 900000 -8394 -2852 -252 -4663 -31 258 -182 731 -2329 -2352 2669 -5850 239 355 -4987 -955 -5 900000 900000 -2508 977 2173 -761 232 -167 978 1425 789 -2156 632 1132 1264 -1134 726 1225 2134 2819 2738 1715 2340 2990 1034 3210 2734 2021 2711 2612 1974 1391 1513 3237 1914 2583 1420 -97 555 1984 4052 3346 3601 5593 1265 1426 453 3015 5155 2820 3030 3555 -1749 2241 2018 -1863 -1731 -1355 -128 1722 -1912 -2898 -700 -2386 779 386 1433 -191 878 1869 -733 -4649 -7067 -3156 -923 -352 -1078 -2691 1762 -4469 -3920 -3748 -954 -732 -4143 -252 -305 1301 996 2943 -2792 -172 1128 -2106 -1103 1978 -452 1870 3650 384 2762 4565 2857 1804 -1302 1768 -1181 -1729 1798 -384 184 -63 1242 -353 -1214 3117 3331 -3403 -369 -881 -4471 SS 20250905T123619.4Z 9379.525225 167 1 54.10 2 78.66 88.88 131.02 269.29 0.00 1 0.00 1 0 25 2.902e-01 1.020e-02 1.417e-01 2.818e-03 5.578772e-01 1.527452e-03 7.055169e-03 -6.000000e+00 1.693142e-01 228.89 -2.00 3.24 -2.00 320.96 0.00e+00 1.869892e-03 7.097359e-04 6.678493e-03 -6.000000e+00 7.771640e-03 293.91 -2.00 20.00 -2.00 320.23 0.00e+00 4.909 0.001 302.00 328.00 3 1.6924e+00 5.2762e-03 6.5826e-02 -6.0000e+00 4.2009e-01 -8.1407e-03 7.0273e-03 5.4356e-02 -6.0000e+00 4.5334e-01 -6.4428e-02 6.3769e-03 1.7948e-02 -6.0000e+00 2.7175e-01 1.4232e-02 3.1070e-03 5.8386e-03 -6.0000e+00 1.1747e-01 4.3143e-04 4.8763e-04 8.4225e-05 7.5057e-05 -6.0000e+00 8.0856e-03 1.7635e-02 0.0000e+00 12 9 8 11 4 0 28.55 32.68 0.56 0.01764 0.02130 119 13 1 5 0 454.530 40.50 20.00 32.68 33.68 4.1 1036.37 -65764 -129779 -102573 -100817 -8957 -80745 -86908 -121109 -91028 23792 -117772 4640 -86930 -67129 -49930 -19597 -15224 -12860 -125 36665 -16133 -8183 -8862 -13447 -14263 -10777 -26412 -13130 -13699 13783 -18658 -1283 -19681 -11212 -13083 -13527 -21733 -10766 1711 -2654 3289 2610 -773 2395 2184 5150 3656 -343 2535 1138 164 5651 4966 3781 1549 4434 4864 -482 805 3251 -204 4128 4488 4296 2176 1424 1107 -2104 -1002 1497 2469 2908 2149 1545 39 112 -3546 -4445 -4150 -1418 -2230 -1461 -2613 -2381 -862 556 819 471 1953 1069 334 -557 -2490 -1658 -1286 -1054 72 901 862 -551 -951 -2379 -2093 -1189 -1112 -2395 -597 364 264 1584 1482 1651 1273 450 -262 -473 -343 451 397 509 124 722 620 443 363 3 -1274 -743 -82 -993 -25 -823 -729 -835 -58 -91 234 923 555 59 66 52 -459 -345 -1524 -999 -957 -31 -565 -695 -1543 -978 89 -1912 24 -1390 -1107 -861 -299 -251 -228 -2 458 -355 -168 -190 -329 -381 -326 -965 -411 -418 333 -718 -49 -1033 -592 -690 -702 -1332 -692 118 -233 311 269 -87 270 251 586 430 -43 318 153 24 885 858 720 323 937 1060 -112 181 703 -47 979 1191 1282 707 458 347 -689 -348 578 1062 1325 997 695 16 43 -1292 -1596 -1591 -614 -1138 -847 -1700 -1649 -628 430 668 401 1661 898 266 -416 -1793 -1173 -976 -909 71 912 967 -643 -1066 -2492 -2195 -1206 -1202 -2552 -657 424 331 2166 2240 2665 2090 724 -402 -687 -490 662 619 840 209 1189 993 688 541 4 -1791 -1040 -124 -1696 -46 -1655 -1537 -1851 -125 -210 555 2221 1361 143 152 115 -1057 SS 20250905T124218.0Z 9379.529376 170 1 53.89 2 77.36 89.62 132.24 270.03 0.00 1 0.00 1 0 25 2.026e-01 9.799e-03 6.332e-02 1.842e-03 5.087145e-01 9.823668e-04 6.355868e-03 -6.000000e+00 1.182105e-01 228.89 -2.00 3.24 -2.00 320.66 0.00e+00 1.933161e-03 4.089477e-04 5.311921e-03 -6.000000e+00 5.425818e-03 293.91 -2.00 20.00 -2.00 319.90 0.00e+00 4.443 0.001 302.00 328.00 3 1.5868e+00 3.2121e-03 5.7124e-02 -6.0000e+00 2.9329e-01 -3.1153e-02 4.1374e-03 4.3800e-02 -6.0000e+00 3.1650e-01 -2.8288e-02 3.6179e-03 1.5246e-02 -6.0000e+00 1.8972e-01 5.4155e-04 1.8044e-03 4.6076e-03 -6.0000e+00 8.2018e-02 7.8312e-04 4.0720e-04 5.5322e-05 6.9903e-05 -6.0000e+00 5.6448e-03 1.7242e-02 0.0000e+00 12 9 8 11 4 0 13.59 32.78 0.47 0.01724 0.02030 165 18 1 5 0 326.540 40.50 20.01 32.78 34.20 4.1 1038.58 -62437 -12838 -92253 -75102 -24860 -81867 -97705 -35692 -69170 -78016 -23851 -31247 -39290 -22997 -28204 3809 -22732 -20627 -5137 -17076 -8345 -17825 -13066 -5616 -14273 -1919 -2860 -12972 -24303 -15491 -9190 -14173 -2754 -8015 -13300 -8839 -7469 -9609 -5037 183 3530 216 363 567 1461 5497 2689 -155 230 2144 477 394 2973 4568 2872 2626 3524 1109 709 733 1138 1960 4028 4395 3441 618 1304 -1301 604 2062 1104 1850 818 825 1044 -841 -3854 -3878 -3272 -2197 -1926 -1684 -1734 -2294 -865 -108 878 1570 1567 989 689 241 -1913 -1858 -1323 -1306 -409 639 475 -737 -916 -1916 -2080 -1529 -1239 -1351 -731 -180 244 1525 1607 1746 1354 725 28 -717 -397 471 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