File name: Pandora85s1_NewOrleansLA-XULA_20250825_L2Fit_fout2c5d20250716p1-8.txt File generation date: 20260326T091759.8Z 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_20250825_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: 20250825 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 20250825T121645.1Z 9368.511633 47 1 53.58 2 81.69 82.56 108.93 79.83 0.00 1 0.00 1 0 17 4.853e-01 1.823e-02 3.448e-01 9.248e-03 7.160178e-01 5.396170e-03 8.383740e-03 -6.000000e+00 2.867401e-01 229.25 -2.00 3.24 -2.00 321.94 0.00e+00 -2.880395e-03 3.285192e-03 1.316093e-02 -6.000000e+00 1.385959e-02 294.31 -2.00 20.00 -2.00 321.36 0.00e+00 6.490 0.003 302.00 328.00 3 1.7004e+00 2.2661e-02 1.0960e-01 -6.0000e+00 7.1131e-01 2.9637e-01 3.2478e-02 1.1676e-01 -6.0000e+00 7.6840e-01 -5.0995e-01 2.9709e-02 3.1456e-02 -6.0000e+00 4.5920e-01 1.9593e-01 1.3508e-02 1.4099e-02 -6.0000e+00 1.9785e-01 8.1121e-05 3.1433e-04 2.8340e-04 6.9809e-05 -6.0000e+00 1.3823e-02 1.7747e-02 0.0000e+00 12 9 8 11 4 0 27.37 33.03 0.72 0.01775 0.02011 51 6 1 5 0 1050.470 41.00 20.01 33.03 32.25 4.0 1030.82 -68845 -164527 -151636 900000 -196039 -84404 900000 -125178 -51667 -24105 -194774 -137491 -37007 -144018 74625 -52934 -28912 2180 -131483 900000 -65983 -58906 900000 900000 -60580 -33615 900000 12933 -97919 -75211 -10173 20657 12794 -47755 -27895 67367 -17910 113136 10604 46082 36959 38073 1293 103459 41802 42349 -11210 59366 20075 38001 35495 23197 22872 17109 25578 22648 24024 19006 9089 7943 18759 20143 23808 14284 3315 5987 32 -5887 7323 12114 3641 9381 1159 7345 -6078 2203 -7688 3702 5761 -4633 -3185 -351 -2725 1357 1107 -2183 -4431 3330 3421 -1616 1901 -2152 -6552 -3210 1158 -1809 -1062 -231 -2009 133 -1039 -4192 -4145 -1249 -2874 -3455 -325 109 1199 -133 1985 350 834 1395 -1407 821 -1234 -998 1678 1378 791 2259 2293 517 1143 -826 -645 -1346 -652 -689 1129 -840 -938 285 -908 -500 347 1115 943 -389 5 -537 -699 -620 -2021 -1739 900000 -3050 -760 900000 -1128 -465 -217 -4626 -2027 -333 -3420 672 -737 -355 21 -5276 900000 -1459 -1206 900000 900000 -1588 -716 900000 169 -3689 -2341 -192 338 262 -1955 -914 828 -557 1112 356 1321 1332 1465 75 2203 1643 1665 -762 2246 1175 1985 2110 1755 1916 1664 2465 2367 2575 2157 1105 945 2011 2286 2938 2200 615 1079 6 -1220 1445 2619 964 2493 336 1912 -1664 498 -1766 754 1256 -1323 -1062 -132 -1176 604 529 -1156 -2534 1827 1895 -920 983 -1086 -3323 -1599 609 -1136 -772 -193 -1913 128 -972 -3716 -3323 -940 -2336 -3022 -291 104 1243 -157 2586 506 1236 2032 -2023 1105 -1680 -1407 2440 2116 1234 3373 3304 736 1556 -1111 -840 -1789 -956 -1156 2077 -1720 -2044 651 -2258 -1321 943 3064 2625 -1069 12 -1314 -1636 SS 20250825T123049.8Z 9368.521410 52 1 53.88 2 78.66 84.26 106.05 81.73 0.00 1 0.00 1 0 25 2.929e-01 1.005e-02 9.500e-02 2.197e-03 5.670104e-01 1.195753e-03 7.079964e-03 -6.000000e+00 1.711289e-01 229.25 -2.00 3.24 -2.00 320.98 0.00e+00 1.156520e-03 5.599854e-04 6.764203e-03 -6.000000e+00 7.857985e-03 294.31 -2.00 20.00 -2.00 320.26 0.00e+00 4.911 0.001 302.00 328.00 3 1.3046e+00 4.1483e-03 6.6635e-02 -6.0000e+00 4.2490e-01 -2.1814e-02 5.5469e-03 5.5798e-02 -6.0000e+00 4.5839e-01 -6.0422e-02 5.0652e-03 1.7211e-02 -6.0000e+00 2.7476e-01 1.6075e-02 2.4665e-03 7.0628e-03 -6.0000e+00 1.1872e-01 6.3151e-04 5.7621e-04 6.5301e-05 7.4063e-05 -6.0000e+00 8.1627e-03 1.8076e-02 0.0000e+00 12 9 8 11 4 0 15.03 33.15 0.53 0.01808 0.02241 172 19 1 5 0 313.220 41.00 20.01 33.15 33.11 4.0 1034.59 -82560 -105449 -42680 -104514 -79176 -124811 -70495 -115306 -86743 -125926 -51263 -46450 -53486 -53361 -37399 -45733 -39569 -22635 -32559 -25557 -26963 -26762 -23992 6024 -16880 676 -16867 -19743 -7077 -5884 -20185 -12955 -4378 -5736 -9774 -15473 -8997 -12424 830 -3148 6768 4896 4473 -1090 3966 2833 2958 587 15 2999 219 2464 2053 1634 3681 2352 1943 2141 1942 243 474 3834 4418 5419 3998 1839 744 -338 542 1253 743 3048 1168 1936 112 -1934 -4066 -3979 -3241 -2628 -2347 -1061 -2064 -2005 -852 -221 579 1438 2007 1171 598 -184 -1622 -2414 -1864 -1145 -503 793 190 -502 -1555 -1993 -1728 -1372 -966 -1429 -668 -354 490 1573 2044 1621 1266 854 -344 -770 -367 178 393 811 -148 737 851 507 -87 -678 -1383 -490 -467 -465 -424 -943 -722 -461 -149 -211 23 1151 579 148 144 -206 -470 -466 -883 -208 -937 -509 -1240 -439 -1280 -828 -1963 -399 -380 -573 -717 -532 -846 -779 -415 -717 -558 -620 -620 -566 127 -485 17 -535 -630 -193 -165 -753 -527 -189 -274 -478 -786 -467 -783 56 -269 599 478 464 -124 433 319 339 70 2 384 32 389 357 311 735 498 428 476 425 53 106 896 1153 1572 1254 580 231 -108 183 481 322 1376 543 860 47 -749 -1477 -1413 -1225 -1148 -1195 -611 -1334 -1382 -621 -172 473 1212 1705 982 474 -137 -1158 -1725 -1430 -994 -453 809 216 -588 -1764 -2090 -1650 -1403 -954 -1516 -741 -418 618 2168 3098 2641 2098 1382 -534 -1135 -531 265 620 1349 -253 1227 1371 795 -132 -991 -1964 -690 -718 -800 -802 -1926 -1416 -947 -325 -492 55 2804 1438 362 335 -456 -1004 SS 20250825T123644.8Z 9368.525518 55 1 54.10 2 77.39 84.97 104.83 82.52 0.00 1 0.00 1 0 25 2.433e-01 1.019e-02 4.327e-02 1.517e-03 5.195624e-01 8.016313e-04 6.539112e-03 -6.000000e+00 1.421642e-01 229.25 -2.00 3.24 -2.00 320.63 0.00e+00 1.564847e-03 3.344555e-04 5.420672e-03 -6.000000e+00 6.527913e-03 294.31 -2.00 20.00 -2.00 319.85 0.00e+00 4.451 0.001 302.00 328.00 3 1.2257e+00 2.5934e-03 5.7553e-02 -6.0000e+00 3.5298e-01 -2.8586e-02 3.3518e-03 4.4566e-02 -6.0000e+00 3.8080e-01 -3.9367e-02 2.9558e-03 1.5169e-02 -6.0000e+00 2.2825e-01 6.7263e-03 1.4799e-03 5.0654e-03 -6.0000e+00 9.8630e-02 1.1012e-03 4.8718e-04 4.4909e-05 5.9497e-05 -6.0000e+00 6.7809e-03 1.7929e-02 0.0000e+00 12 9 8 11 4 0 2.42 33.23 0.40 0.01793 0.02159 233 26 1 5 0 232.150 41.00 20.01 33.23 33.52 4.0 1036.22 -87200 -88657 -85047 -98501 -90052 -88103 -104334 -38367 -47098 -41639 -66153 -75575 -31212 -35181 -19125 -27522 -8231 -9874 -10999 -8681 -11238 -14495 -12800 -22538 -4813 -3448 1668 -12565 -7572 -5331 -9110 -6200 -5783 -6255 -11084 -11687 -7620 -7503 -3622 2396 146 3304 2365 1026 3562 1606 1684 835 -57 3365 1749 3232 804 2854 3173 1951 3755 549 -477 957 1438 2191 3670 3939 2880 372 559 -426 292 1185 1586 1896 1266 622 -148 -1814 -1803 -3797 -2811 -2742 -1801 -1476 -2112 -2116 -574 371 1000 1257 1983 1613 803 79 -1751 -2181 -1756 -1335 -422 602 398 -91 -986 -2243 -2580 -1346 -1156 -1402 -786 -293 383 1700 1813 1669 1482 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