File name: Pandora85s1_NewOrleansLA-XULA_20260322_L2Fit_fout2c6d20250326p1-8.txt File generation date: 20260323T061153.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 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_v6d20250326.txt Level 1 file used: Pandora85s1_NewOrleansLA-XULA_20260322_L1_smca1c6d20250326p1-8.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: 20260322 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: OOB session based on clearance session 3 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0210 305.1616 305.3022 305.4428 305.5834 305.7240 305.8645 306.0051 306.1456 306.2862 306.4267 306.5672 306.7077 306.8481 306.9886 307.1291 307.2695 307.4099 307.5504 307.6908 307.8312 307.9716 308.1119 308.2523 308.3927 308.5330 308.6733 308.8136 308.9540 309.0943 309.2345 309.3748 309.5151 309.6553 309.7956 309.9358 310.0760 310.2162 310.3564 310.4966 310.6368 310.7769 310.9171 311.0572 311.1973 311.3375 311.4776 311.6176 311.7577 311.8978 312.0379 312.1779 312.3179 312.4580 312.5980 312.7380 312.8780 313.0179 313.1579 313.2978 313.4378 313.5777 313.7176 313.8576 313.9974 314.1373 314.2772 314.4171 314.5569 314.6968 314.8366 314.9764 315.1162 315.2560 315.3958 315.5356 315.6753 315.8151 315.9548 316.0945 316.2342 316.3739 316.5136 316.6533 316.7930 316.9326 317.0723 317.2119 317.3515 317.4911 317.6307 317.7703 317.9099 318.0494 318.1890 318.3285 318.4681 318.6076 318.7471 318.8866 319.0261 319.1655 319.3050 319.4444 319.5839 319.7233 319.8627 320.0021 320.1415 320.2809 320.4202 320.5596 320.6989 320.8383 320.9776 321.1169 321.2562 321.3955 321.5347 321.6740 321.8133 321.9525 322.0917 322.2309 322.3701 322.5093 322.6485 322.7877 322.9268 323.0660 323.2051 323.3442 323.4834 323.6225 323.7615 323.9006 324.0397 324.1787 324.3178 324.4568 324.5958 324.7348 324.8738 --------------------------------------------------------------------------------------- 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 20260322T123153.3Z 9577.522145 43 1 54.27 2 84.30 92.42 107.76 51.36 0.00 1 0.00 1 0 25 5.113e-01 5.223e-02 4.923e-01 5.090e-02 8.715709e-01 3.151588e-02 9.132318e-03 -6.000000e+00 3.079950e-01 227.60 -2.00 3.24 -2.00 322.13 0.00e+00 -1.474940e-02 1.330833e-02 7.622544e-03 -6.000000e+00 1.557359e-02 286.26 -2.00 20.00 -2.00 321.59 0.00e+00 8.888 0.008 302.00 328.00 3 9.0738e-01 1.1255e-01 1.1465e-01 -6.0000e+00 7.6916e-01 1.5985e+00 1.3357e-01 9.4940e-02 -6.0000e+00 8.3949e-01 -2.0029e+00 8.0720e-02 2.3849e-02 -6.0000e+00 4.9324e-01 7.4903e-01 4.3162e-02 1.8530e-02 -6.0000e+00 2.1205e-01 1.2616e-05 4.9399e-04 1.5586e-03 1.5552e-04 -6.0000e+00 1.5663e-02 -7.7139e-03 0.0000e+00 12 8 8 10 0 0 46.45 24.55 1.25 -0.00771 -0.00400 17 2 1 5 0 3192.020 32.75 20.00 24.55 21.96 4.5 986.82 900000 -26325 94266 900000 900000 91287 900000 97809 145505 -17045 900000 89977 900000 105084 113175 900000 59467 900000 23300 76606 -4930 -35188 900000 75430 -6741 96440 80263 -62715 900000 900000 -74572 1873 900000 900000 6386 900000 80696 -18279 900000 6538 900000 900000 69498 33653 89888 174828 -24630 17082 76656 -36012 18642 119776 225431 47779 53868 81508 146919 -10331 33152 -20658 -53119 69774 -26472 48981 7916 76533 28375 27574 4555 17111 -1483 11678 17474 -31055 -8301 7377 -23070 -24906 15083 -9475 28260 -27167 19464 -7510 -6448 -10518 -2695 5693 10716 21118 11838 15454 22087 971 -17951 35733 6987 6202 -5168 3709 -932 -5425 6750 -17039 -12958 -3955 -3968 9830 8364 4557 -790 2313 4277 2855 1279 -1815 3819 2115 -1053 -1390 2391 -3648 2360 -822 -445 -7637 2380 1935 1016 -1989 3245 2229 -5800 -3104 -338 1949 -2060 261 2380 3714 -1754 -1255 862 900000 -3906 4663 900000 900000 4515 900000 4838 7197 -1475 900000 4450 900000 5198 5598 900000 3187 900000 1729 3789 -427 -3771 900000 3731 -667 4770 3970 -9306 900000 900000 -10395 135 900000 900000 459 900000 3991 -1726 900000 676 900000 900000 4375 2875 4446 8647 -3101 1383 3792 -5182 1676 5924 11150 4082 4602 5498 7267 -1765 3429 -3344 -11226 4392 -4761 4625 1210 5850 3445 3472 778 2924 -340 2468 3457 -9356 -1792 1194 -4564 -4928 2170 -2045 5451 -9651 5391 -2934 -2647 -4786 -1186 2365 4240 7312 4216 4969 6446 360 -8968 12195 3732 3896 -4115 2826 -719 -4025 3973 -12052 -9230 -2758 -2924 6807 6496 4193 -883 2803 5373 3672 1632 -2307 4553 2657 -1442 -2008 3347 -5232 3058 -1070 -559 -10048 2767 2297 1366 -3217 5681 4377 -13339 -7463 -855 5168 -5900 744 6698 10030 -4685 -3105 1967 SS 20260322T124453.0Z 9577.531168 46 1 54.11 2 81.49 94.06 105.60 53.36 0.00 1 0.00 1 0 33 5.853e-01 1.354e-02 2.836e-01 5.277e-03 7.272445e-01 2.949067e-03 9.531353e-03 -6.000000e+00 3.406065e-01 227.60 -2.00 3.24 -2.00 321.73 0.00e+00 1.978617e-03 1.702777e-03 1.334087e-02 -6.000000e+00 1.518232e-02 286.26 -2.00 20.00 -2.00 321.23 0.00e+00 6.362 0.003 302.00 328.00 3 8.2611e-01 1.1514e-02 1.0244e-01 -6.0000e+00 8.4491e-01 2.1133e-01 1.7210e-02 1.0341e-01 -6.0000e+00 9.1306e-01 -3.3630e-01 1.7651e-02 3.9680e-02 -6.0000e+00 5.4526e-01 1.2412e-01 8.0050e-03 6.5124e-03 -6.0000e+00 2.3517e-01 2.0906e-04 3.2672e-04 1.5163e-04 2.1051e-04 -6.0000e+00 1.6297e-02 -9.7902e-03 0.0000e+00 12 8 8 10 0 0 64.81 24.62 0.60 -0.00979 -0.00734 95 11 1 5 0 569.480 32.75 20.01 24.62 22.75 4.4 990.74 -248158 -183035 -109596 -97470 -161722 -12197 -205985 -185296 -199158 -146684 -166363 -199779 -174885 200714 -114939 -63074 -88845 -32476 17240 9723 -27617 6896 -28753 -34974 -22983 -36076 -58181 -45111 -10299 -32093 -24010 -24090 -2980 34817 -23561 -31794 -41696 -10537 -7167 2482 -1609 13695 -2688 22162 -2873 12271 3274 4230 -1398 -7561 16675 15907 9741 14936 11462 7602 12387 5324 6235 -2271 7005 4847 9532 4976 9745 5447 457 -964 1041 8181 8159 4858 5623 4178 2093 -397 -2194 -3867 -5854 -5590 -3497 300 -565 -2206 -2153 -437 337 1847 1275 2087 267 -1183 -2802 -4465 -3506 -2790 -544 320 1076 -202 -1608 -3154 -2646 -1484 -1940 -1581 -1155 -453 -121 1493 1927 1798 1797 592 -598 -1255 -1342 -267 461 1097 941 1226 1555 1137 293 -400 -1637 -1453 -282 -266 -484 -381 -665 -657 -487 -57 -43 902 1087 253 -6 -570 -717 -3135 -1456 -564 -502 -1059 -63 -2120 -1734 -2423 -1167 -1712 -3178 -2700 1033 -1613 -649 -1372 -319 113 73 -310 55 -336 -475 -301 -574 -1198 -802 -125 -511 -416 -507 -60 538 -650 -922 -1424 -306 -245 103 -81 648 -159 1061 -179 669 201 266 -98 -603 1159 1261 912 1461 1256 912 1473 688 780 -300 851 646 1374 860 1765 1043 91 -200 229 1916 2167 1427 1661 1202 568 -99 -511 -904 -1516 -1703 -1244 120 -257 -1099 -1143 -245 198 1112 783 1250 154 -647 -1490 -2431 -2068 -1892 -423 287 1082 -215 -1679 -3081 -2314 -1218 -1679 -1460 -1121 -469 -136 1853 2691 2763 2869 949 -933 -1883 -1983 -403 731 1822 1587 2004 2437 1735 434 -576 -2317 -2057 -435 -470 -960 -753 -1405 -1472 -1167 -144 -113 2415 2942 677 -16 -1365 -1633 SS 20260322T125755.8Z 9577.540229 51 1 54.03 2 78.67 95.73 103.38 55.27 0.00 1 0.00 1 0 25 3.261e-01 1.049e-02 6.494e-02 1.592e-03 5.877634e-01 8.525094e-04 7.614021e-03 -6.000000e+00 1.897661e-01 227.60 -2.00 3.24 -2.00 320.95 0.00e+00 3.920282e-03 3.892289e-04 7.106259e-03 -6.000000e+00 8.458683e-03 286.26 -2.00 20.00 -2.00 320.34 0.00e+00 4.917 0.001 302.00 328.00 3 5.7794e-01 2.8417e-03 6.5830e-02 -6.0000e+00 4.7073e-01 3.1143e-02 3.8150e-03 5.2868e-02 -6.0000e+00 5.0871e-01 -7.5788e-02 3.7093e-03 2.3020e-02 -6.0000e+00 3.0379e-01 1.9723e-02 1.7958e-03 4.7117e-03 -6.0000e+00 1.3102e-01 1.2040e-03 1.6523e-04 4.6235e-05 1.3340e-04 -6.0000e+00 9.0799e-03 -9.8152e-03 0.0000e+00 12 8 8 10 0 0 70.30 24.73 0.46 -0.00982 -0.00857 260 29 1 5 0 207.790 32.75 20.01 24.73 23.99 4.5 995.65 -127187 -113184 -102710 -85132 -51999 -124167 -89834 -120902 -105972 -121175 -89430 -61304 -79476 -58119 -51739 -22990 -15768 -24031 -20176 -15907 -8045 -25078 -17873 -17389 -13535 -23874 -13658 -24741 -25586 -14964 -12160 -7560 -12489 -7272 -4291 -11698 -15731 -6459 -3070 -1513 1472 1894 2107 -55 679 2327 1638 1891 3293 282 1300 2063 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