File name: Pandora236s1_NewLondonCT_20231215_L2Fit_fout2c4d20220606p1-8.txt File generation date: 20240319T004109.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Brooke S.Stutzman Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 236 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora236_OF_v3d20220107.txt Instrument calibration file used: Pandora236s1_CF_v4d20220606.txt Level 1 file used: Pandora236s1_NewLondonCT_20231215_L1_smca1c4d20220606p1-8.txt Full location name: United States Coast Guard Academy Short location name: NewLondonCT Country of location: United States Location latitude [deg]: 41.3758 Location longitude [deg]: -72.1004 Location altitude [m]: 30 Local noon date: 20231215 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: Modification of session 3 "1.8 field calibration all gases" change in SO2 First and last pixel inside fitting window: 197 338 Nominal wavelengths inside fitting window [nm]: 305.1267 305.2679 305.4091 305.5502 305.6914 305.8325 305.9737 306.1148 306.2559 306.3970 306.5381 306.6792 306.8203 306.9613 307.1024 307.2434 307.3845 307.5255 307.6665 307.8075 307.9485 308.0894 308.2304 308.3714 308.5123 308.6532 308.7942 308.9351 309.0760 309.2169 309.3577 309.4986 309.6395 309.7803 309.9211 310.0620 310.2028 310.3436 310.4844 310.6251 310.7659 310.9067 311.0474 311.1881 311.3289 311.4696 311.6103 311.7510 311.8916 312.0323 312.1730 312.3136 312.4543 312.5949 312.7355 312.8761 313.0167 313.1573 313.2978 313.4384 313.5790 313.7195 313.8600 314.0005 314.1410 314.2815 314.4220 314.5625 314.7029 314.8434 314.9838 315.1243 315.2647 315.4051 315.5455 315.6859 315.8262 315.9666 316.1070 316.2473 316.3876 316.5279 316.6682 316.8085 316.9488 317.0891 317.2294 317.3696 317.5099 317.6501 317.7903 317.9305 318.0707 318.2109 318.3511 318.4912 318.6314 318.7715 318.9117 319.0518 319.1919 319.3320 319.4721 319.6121 319.7522 319.8923 320.0323 320.1723 320.3124 320.4524 320.5924 320.7323 320.8723 321.0123 321.1522 321.2922 321.4321 321.5720 321.7119 321.8518 321.9917 322.1316 322.2715 322.4113 322.5512 322.6910 322.8308 322.9706 323.1104 323.2502 323.3900 323.5297 323.6695 323.8092 323.9490 324.0887 324.2284 324.3681 324.5078 324.6474 324.7871 324.9268 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20231215T125343.5Z 8749.537309 58 1 51.76 2 83.69 128.84 111.06 107.02 0.00 1 0.00 1 0 25 5.518e-01 3.117e-02 4.215e-01 2.410e-02 8.933843e-01 1.369177e-02 9.795596e-03 -6.000000e+00 3.065082e-01 222.70 -2.00 3.52 -2.00 322.19 0.00e+00 5.540562e-03 6.907703e-03 3.132549e-03 -6.000000e+00 1.406742e-02 276.69 -2.00 20.00 -2.00 321.74 0.00e+00 8.205 0.010 302.00 328.00 3 6.1639e-01 4.9560e-02 9.7050e-02 -6.0000e+00 7.5608e-01 1.3261e+00 6.2880e-02 5.8501e-02 -6.0000e+00 8.2683e-01 -1.5460e+00 5.2296e-02 2.6278e-02 -6.0000e+00 4.9174e-01 5.8945e-01 2.5933e-02 9.9492e-03 -6.0000e+00 2.1344e-01 3.0725e-05 -1.8515e-03 6.4887e-04 1.1508e-04 -6.0000e+00 1.4372e-02 3.3559e-03 0.0000e+00 12 8 8 10 0 0 29.43 23.50 0.63 0.00336 -0.01056 37 6 1 5 0 1398.800 25.90 19.99 23.50 9.66 11.8 922.99 900000 -76817 -9315 -27881 99692 -61980 40444 -16580 -117846 -6993 -88527 900000 -6971 -19525 -12008 -19982 299438 54739 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4480 2167 4911 3389 2691 -2956 6195 2944 4139 3763 1210 1864 2348 4315 3015 5006 4680 555 1152 -1066 890 -2085 1471 947 -2 -1691 -265 -3118 3423 1462 630 5994 1332 3601 448 -2555 -262 -2023 -2112 -2423 -1113 2047 -4372 378 -6233 -764 -7000 2913 -3024 -1239 -5445 -2244 -4974 -2792 1787 1138 -3603 -2370 128 -2603 -961 3230 -1833 4339 2413 3908 2972 5885 -87 4131 4961 2894 -2273 939 -1643 1842 -533 -1168 1324 2517 5181 659 -2802 -1473 -3175 -5485 SS 20231215T130402.2Z 8749.544470 61 1 50.95 2 82.20 130.70 109.29 108.44 0.00 1 0.00 1 0 17 5.297e-01 2.351e-02 2.750e-01 7.136e-03 7.570047e-01 3.921640e-03 8.976051e-03 -6.000000e+00 2.932902e-01 222.70 -2.00 3.52 -2.00 321.91 0.00e+00 -1.781005e-03 2.092662e-03 9.140136e-03 -6.000000e+00 1.285096e-02 276.69 -2.00 20.00 -2.00 321.45 0.00e+00 6.871 0.006 302.00 328.00 3 6.9616e-01 1.4333e-02 9.3769e-02 -6.0000e+00 7.2229e-01 3.9274e-01 2.0673e-02 7.9053e-02 -6.0000e+00 7.8802e-01 -4.7550e-01 2.1669e-02 3.3922e-02 -6.0000e+00 4.6933e-01 1.7700e-01 1.0082e-02 7.6402e-03 -6.0000e+00 2.0257e-01 1.4270e-04 -3.9514e-04 2.0303e-04 1.4972e-04 -6.0000e+00 1.3730e-02 3.1685e-03 0.0000e+00 12 8 8 10 0 0 39.30 23.50 0.38 0.00317 0.00020 91 16 1 5 0 559.860 25.90 20.01 23.50 10.48 11.7 926.58 -128186 -218699 -117147 -165303 -76051 -169693 -163337 -202532 -153673 -131768 -82045 -199096 -134817 -79197 -53245 40832 -90599 -9931 -37829 38359 -28218 -46871 -61857 -39255 -31947 -31063 -33980 -91423 -7563 -55122 -35125 22169 41823 -2151 -21695 -18567 -15251 38997 36125 11905 24594 27133 29578 15279 72195 11879 11335 -1945 20819 15915 24613 12797 17048 12412 14738 18550 5692 10081 10856 9570 20937 14626 6674 15323 5950 6782 5889 10341 8480 7651 8014 5427 9474 4301 9236 -2005 -845 2344 2257 -6 950 -1650 1295 1334 471 1896 -27487 2559 5137 1127 1459 -1753 -2966 687 -694 726 814 1099 392 -873 -2654 -338 -1036 -1368 -886 657 -805 17 1382 788 653 400 -20 -896 -608 -39 414 1181 962 -89 780 1239 1167 1578 377 -35 338 -56 -819 -619 -695 -805 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4.061477e-04 1.771045e-03 -6.000000e+00 6.871697e-03 276.69 -2.00 20.00 -2.00 320.61 0.00e+00 5.145 0.002 302.00 328.00 3 4.7819e-01 2.9371e-03 5.9931e-02 -6.0000e+00 3.8626e-01 1.1227e-01 3.9963e-03 3.2455e-02 -6.0000e+00 4.2140e-01 -1.0675e-01 4.1889e-03 1.9212e-02 -6.0000e+00 2.5098e-01 3.3186e-02 2.0429e-03 7.8381e-03 -6.0000e+00 1.0833e-01 1.0568e-03 -2.6693e-04 4.9205e-05 8.9545e-05 -6.0000e+00 7.3416e-03 2.5245e-03 0.0000e+00 11 8 0 10 0 0 34.77 23.48 0.32 0.00252 0.00052 290 50 1 5 0 176.210 25.90 20.01 23.48 10.88 12.1 931.83 -40951 -67183 -103466 -96091 -109585 -113081 -93531 -91067 -81997 -95255 -71878 -78185 -66092 -19453 -22935 -18351 -31808 -16823 -27964 -24815 -40212 -16449 -19507 -7470 -28063 -2071 -22127 -20673 -20045 -6532 -1758 1583 406 -4951 -7498 -9036 -5238 -3769 1467 -2117 579 -206 2232 4177 3429 2034 4189 4505 2053 2548 2746 3055 2670 4540 1319 2010 515 76 499 208 2449 2016 4640 1582 1424 1238 869 1341 2437 1827 1881 1118 788 -492 -340 -2804 -3263 -1384 -1735 -794 -1304 -1876 -2014 -1375 -797 32 1832 976 859 237 134 -684 -712 -617 -551 7 1274 264 40 -374 -1014 -831 -98 -1155 -1453 -838 -906 -162 249 441 308 178 -176 -174 78 261 235 565 39 -34 448 555 484 530 -20 -226 794 191 -90 -283 -324 -453 -255 -91 -139 5 610 70 -11 75 -421 -171 -196 -472 -1081 -856 -1032 -1142 -865 -936 -857 -1191 -751 -1058 -1030 -243 -369 -327 -719 -360 -714 -642 -1212 -394 -521 -192 -942 -56 -724 -641 -632 -208 -64 66 19 -248 -362 -469 -302 -261 107 -186 54 -20 226 421 356 219 453 506 248 335 406 495 474 849 265 415 109 16 100 42 529 495 1266 484 430 362 257 422 875 746 815 491 332 -194 -120 -923 -1057 -475 -706 -377 -716 -1153 -1314 -949 -587 24 1440 781 672 174 91 -445 -462 -438 -451 7 1364 318 49 -437 -1080 -794 -91 -1171 -1574 -947 -1095 -210 360 648 483 282 -271 -274 116 386 362 922 62 -54 748 895 755 791 -29 -315 1112 301 -161 -510 -624 -913 -540 -206 -333 13 1516 176 -27 173 -913 -356 SS 20231215T133106.5Z 8749.563269 73 1 51.12 2 78.50 135.76 104.71 112.20 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