File name: Pandora179s1_CornwallCT_20231121_L2Fit_fout2c40d20221201p1-8.txt File generation date: 20240124T084202.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c40p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 179 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora179_OF_v3d20220331.txt Instrument calibration file used: Pandora179s1_CF_v40d20221201.txt Level 1 file used: Pandora179s1_CornwallCT_20231121_L1_smca1c40d20221201p1-8.txt Full location name: Cornwall - Mohawk Mt CTDEEP (USEPA AQS Site ID 09-005-0005) Short location name: CornwallCT Country of location: United States Location latitude [deg]: 41.8213 Location longitude [deg]: -73.2973 Location altitude [m]: 505 Local noon date: 20231121 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: None First and last pixel inside fitting window: 205 347 Nominal wavelengths inside fitting window [nm]: 305.0173 305.1585 305.2997 305.4409 305.5821 305.7232 305.8644 306.0055 306.1467 306.2878 306.4289 306.5700 306.7111 306.8521 306.9932 307.1343 307.2753 307.4163 307.5573 307.6983 307.8393 307.9803 308.1213 308.2623 308.4032 308.5442 308.6851 308.8260 308.9669 309.1078 309.2487 309.3896 309.5304 309.6713 309.8121 309.9529 310.0938 310.2346 310.3754 310.5161 310.6569 310.7977 310.9384 311.0792 311.2199 311.3606 311.5013 311.6420 311.7827 311.9234 312.0640 312.2047 312.3453 312.4859 312.6265 312.7672 312.9077 313.0483 313.1889 313.3295 313.4700 313.6105 313.7511 313.8916 314.0321 314.1726 314.3131 314.4535 314.5940 314.7344 314.8749 315.0153 315.1557 315.2961 315.4365 315.5769 315.7173 315.8576 315.9980 316.1383 316.2786 316.4189 316.5592 316.6995 316.8398 316.9801 317.1203 317.2606 317.4008 317.5410 317.6812 317.8214 317.9616 318.1018 318.2420 318.3821 318.5223 318.6624 318.8025 318.9426 319.0827 319.2228 319.3629 319.5029 319.6430 319.7830 319.9231 320.0631 320.2031 320.3431 320.4831 320.6230 320.7630 320.9029 321.0429 321.1828 321.3227 321.4626 321.6025 321.7424 321.8823 322.0221 322.1620 322.3018 322.4416 322.5814 322.7212 322.8610 323.0008 323.1406 323.2803 323.4201 323.5598 323.6995 323.8392 323.9789 324.1186 324.2583 324.3980 324.5376 324.6773 324.8169 324.9565 --------------------------------------------------------------------------------------- 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 20231121T122446.0Z 8725.517199 62 1 47.72 2 85.14 122.34 147.90 13.88 0.00 1 0.00 1 0 25 8.597e-01 4.865e-02 3.689e-01 2.007e-02 1.124810e+00 1.156718e-02 1.277320e-02 -6.000000e+00 4.926225e-01 222.74 -2.00 3.52 -2.00 322.35 0.00e+00 -1.473723e-02 4.960422e-03 2.737469e-03 -6.000000e+00 2.206622e-02 276.16 -2.00 20.00 -2.00 321.87 0.00e+00 10.051 0.019 302.00 328.00 3 -1.4156e-01 3.9537e-02 1.1115e-01 -6.0000e+00 1.2190e+00 2.2361e+00 4.9258e-02 5.7756e-02 -6.0000e+00 1.3402e+00 -2.5454e+00 3.4632e-02 3.2825e-02 -6.0000e+00 7.8953e-01 9.3863e-01 1.8412e-02 1.5131e-02 -6.0000e+00 3.3117e-01 1.3405e-05 -1.3809e-03 4.9253e-04 2.2500e-04 -6.0000e+00 2.3844e-02 1.0530e-02 0.0000e+00 12 8 8 10 0 0 86.83 22.62 1.16 0.01053 0.00015 31 7 1 5 0 1539.150 25.79 20.00 22.62 -0.83 25.3 858.59 70081 900000 61935 106957 85361 30037 64354 -58600 143749 306024 -58936 -30219 -15128 5745 900000 164182 253840 164920 56428 900000 20458 197868 900000 47711 900000 387881 24546 27175 -28927 -3369 193968 -66631 900000 900000 209447 249558 -51640 301134 147801 900000 14095 106043 28828 67004 -17316 25055 -44690 312114 71402 8420 106664 900000 13194 29419 98823 900000 10518 4628 41089 92012 27190 48712 52296 67987 23204 -16137 18752 16550 -22881 33502 65950 46220 88869 -13496 20261 6797 73130 -4917 -783 -12783 -24216 6732 22453 -8020 23202 60201 7926 10089 13225 -4720 8645 -8806 2432 26491 12291 -4917 -4119 -644 -247 -8870 -4054 -8317 970 -2338 -1405 10641 15191 -12032 -9947 1602 3241 -3365 -2583 -1431 -1411 -1159 906 2247 1494 -330 8335 -6538 2884 2393 -3685 11160 -3680 3330 1097 1623 -137 2331 -1421 99 -3921 3417 436 2117 194 -1660 613 -811 -2699 4678 900000 4033 3989 3032 1547 2286 -6868 2808 5978 -7850 -3059 -1451 500 900000 3499 4959 3515 3407 900000 1453 3865 900000 2372 900000 7577 1526 1400 -2209 -191 3789 -9230 900000 900000 4092 4875 -5594 5883 2887 900000 1352 4143 2355 3451 -1876 1811 -5635 6097 3208 757 3959 900000 1495 3046 5405 900000 1459 651 3612 4314 2284 3426 3984 5047 2901 -2995 2491 2392 -5453 5170 7988 6952 8333 -3164 2929 969 5000 -768 -136 -3047 -7758 1854 5921 -3055 6799 12701 2895 3627 4495 -1816 2702 -3131 784 7400 4682 -2680 -2655 -470 -200 -7919 -3223 -6076 568 -1375 -867 6153 8933 -10225 -9522 1624 3793 -4267 -3421 -1891 -1825 -1464 1137 2913 2044 -464 11283 -9579 3663 2973 -4744 12100 -4594 4261 1726 2749 -271 4988 -3438 258 -11420 9685 1289 6173 563 -4593 1506 -1842 -5977 SS 20231121T123545.8Z 8725.524835 65 1 48.57 2 83.43 124.29 147.31 18.57 0.00 1 0.00 1 0 17 6.507e-01 1.648e-02 2.635e-01 5.026e-03 9.165912e-01 2.781703e-03 9.793734e-03 -6.000000e+00 3.687336e-01 222.74 -2.00 3.52 -2.00 322.11 0.00e+00 1.019326e-02 1.612348e-03 5.751460e-03 -6.000000e+00 1.627413e-02 276.16 -2.00 20.00 -2.00 321.68 0.00e+00 7.947 0.009 302.00 328.00 3 1.3589e-01 1.0481e-02 9.8719e-02 -6.0000e+00 9.1055e-01 6.9049e-01 1.6125e-02 7.9205e-02 -6.0000e+00 9.9781e-01 -8.5285e-01 1.7646e-02 3.1209e-02 -6.0000e+00 5.9222e-01 3.3637e-01 8.0032e-03 1.2984e-02 -6.0000e+00 2.4969e-01 1.0765e-04 -1.7360e-03 1.3204e-04 1.2493e-04 -6.0000e+00 1.7862e-02 9.8810e-03 0.0000e+00 12 8 8 10 0 0 -1.27 22.62 0.45 0.00988 -0.00316 111 27 1 5 0 437.480 25.79 19.99 22.62 0.09 25.7 866.51 -239378 900000 -253200 -114424 -199608 -117469 -177418 -262719 -149579 -35642 -243194 -181893 -172286 -157954 900000 -99620 29316 -71879 -54398 900000 -44846 31172 15888 -67601 11019 25566 -112602 -42309 -118499 -73414 51199 -79219 12388 900000 24778 16866 -21777 -28441 -12049 96019 7446 23404 39612 16878 855 30225 -20993 63579 7268 11716 21126 41958 11956 30727 31550 38170 27243 7665 23373 16209 25412 843 16673 7970 15738 7434 12717 14032 4054 13325 10667 12729 11698 4054 -677 3607 2836 -2851 1872 109 -575 479 1666 -3199 -50 3032 1844 838 2082 287 1146 -1464 -1511 1478 -2760 -2109 -2042 -545 -323 -1225 -1000 -2733 -239 -2440 -2075 -1242 -537 -3323 -1756 -651 -330 -882 -962 -181 -878 128 -62 199 194 174 679 231 1858 1094 1527 2466 151 1073 420 930 727 271 41 264 -604 446 -40 327 -145 -20 -87 -710 -1349 -3410 900000 -5524 -611 -2222 -575 -1422 -5147 -999 -175 -4439 -2025 -2301 -2532 900000 -1508 158 -1088 -826 900000 -637 198 117 -1192 92 188 -3309 -601 -3598 -1582 401 -2910 218 900000 413 289 -576 -919 -395 1270 270 779 1183 653 39 1066 -1285 1775 384 648 1200 2199 937 2182 2364 2767 2242 755 1877 1350 1966 92 1813 1105 2220 1158 1906 2192 776 2682 2440 2967 2698 935 -147 664 496 -553 403 29 -188 181 631 -1358 -22 1358 874 411 1005 136 553 -687 -701 713 -1469 -1338 -1546 -477 -315 -1220 -933 -2306 -175 -1787 -1611 -1013 -462 -3209 -1885 -804 -465 -1253 -1410 -261 -1337 187 -92 310 292 268 1011 356 2694 1550 2086 3244 200 1516 701 1650 1458 596 98 667 -1529 1169 -108 881 -388 -51 -220 -1672 -3080 SS 20231121T124619.8Z 8725.532173 68 1 48.53 2 81.82 126.20 146.60 22.93 0.00 1 0.00 1 0 17 6.726e-01 1.032e-02 1.093e-01 2.270e-03 7.914893e-01 1.205512e-03 8.681110e-03 -6.000000e+00 3.776148e-01 222.74 -2.00 3.52 -2.00 321.55 0.00e+00 5.141838e-03 6.182672e-04 9.153448e-04 -6.000000e+00 1.656165e-02 276.16 -2.00 20.00 -2.00 321.08 0.00e+00 6.598 0.005 302.00 328.00 3 2.5745e-01 4.1512e-03 7.4773e-02 -6.0000e+00 9.2949e-01 2.5177e-01 6.1514e-03 4.4106e-02 -6.0000e+00 1.0148e+00 -3.0491e-01 6.8268e-03 2.3937e-02 -6.0000e+00 6.0469e-01 1.1783e-01 3.1897e-03 9.9841e-03 -6.0000e+00 2.5602e-01 3.8543e-04 -1.0792e-03 6.0508e-05 1.1053e-04 -6.0000e+00 1.8322e-02 9.6866e-03 0.0000e+00 12 8 8 10 0 0 82.07 22.61 0.33 0.00969 0.00158 210 50 1 5 0 231.050 25.79 20.00 22.61 1.30 25.6 872.62 -238571 -130384 -227254 -222528 -246928 -164021 -248376 -204967 -188613 -161291 -228512 -194289 -171261 -134148 -31495 -81533 -53891 -77831 -37275 -36808 -39231 -66430 -11912 -72942 -34734 -33247 -72200 -42209 -62098 -34655 -28818 -35273 -12347 19873 -6039 -6961 -22627 -8535 -3240 3906 8673 2190 9489 -170 677 4739 -8066 7485 3903 7372 5170 12494 2809 11988 9180 10943 4621 3941 3876 3813 4635 3723 7578 6689 6061 2872 4606 2654 1634 3758 3064 3680 2302 2095 -49 455 -1617 -670 -590 -601 -1578 -791 -1001 -1797 367 -309 477 -778 842 310 443 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