File name: Pandora179s1_CornwallCT_20230511_L2Fit_fout2c40d20221201p1-8.txt File generation date: 20260624T054449.5Z 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 v1.8.88 Instrument operation file used: Pandora179_OF_v3d20220331.txt Instrument calibration file used: Pandora179s1_CF_v40d20221201.txt Level 1 file used: Pandora179s1_CornwallCT_20230511_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: 20230511 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 20230511T104559.4Z 8531.448605 182 1 47.90 2 78.85 75.92 67.23 188.23 0.00 1 0.00 1 0 25 5.835e-01 3.354e-02 2.404e-01 7.708e-03 7.841045e-01 4.361652e-03 8.643232e-03 -6.000000e+00 3.462643e-01 230.40 -2.00 3.52 -2.00 321.29 0.00e+00 -6.164942e-03 2.068464e-03 2.220091e-03 -6.000000e+00 1.701781e-02 279.92 -2.00 20.00 -2.00 320.77 0.00e+00 4.990 0.002 302.00 328.00 3 4.0036e+00 1.4471e-02 6.5339e-02 -6.0000e+00 8.7443e-01 4.7515e-01 1.9938e-02 4.8841e-02 -6.0000e+00 9.5539e-01 -7.4512e-01 1.8959e-02 2.2189e-02 -6.0000e+00 5.5864e-01 3.4162e-01 8.8831e-03 9.3842e-03 -6.0000e+00 2.3601e-01 3.5121e-05 -8.8990e-04 2.1413e-04 9.0742e-05 -6.0000e+00 1.6602e-02 1.8595e-03 0.0000e+00 12 9 8 11 32 0 41.24 22.78 0.73 0.00186 -0.00483 13 3 1 5 0 3684.210 26.00 19.99 22.78 17.58 20.5 994.58 900000 900000 -94294 900000 -19018 900000 -34280 -176632 900000 900000 -213119 900000 -153494 900000 900000 31556 900000 -58636 13705 900000 43418 -71907 900000 -41976 41198 116544 12515 11664 -31654 208983 48006 50724 73808 900000 40887 164051 -43621 122321 167675 289339 56001 65786 74761 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2091 1484 1335 -487 2497 -3349 3244 -1931 -2600 -1775 -1110 -910 -6518 -1127 -3167 -2464 -4312 291 -1719 -1367 -347 -6769 4080 -2586 -3271 -776 3767 -3326 -1526 345 3064 866 -1963 1860 -1697 862 1855 1148 4087 7078 -382 1557 -1009 2176 2773 2068 4290 1698 2266 -1676 -4120 2401 2226 965 -272 -1882 -1926 -1537 -5831 SS 20230511T105157.5Z 8531.452749 185 1 49.48 2 77.76 76.86 67.38 189.65 0.00 1 0.00 1 0 17 5.643e-01 2.023e-02 2.213e-01 4.647e-03 7.328011e-01 2.510551e-03 8.168908e-03 -6.000000e+00 3.286421e-01 230.40 -2.00 3.52 -2.00 320.94 0.00e+00 3.024814e-03 1.083734e-03 6.242908e-04 -6.000000e+00 1.448520e-02 279.92 -2.00 20.00 -2.00 320.39 0.00e+00 4.582 0.002 302.00 328.00 3 3.5744e+00 7.9905e-03 5.8507e-02 -6.0000e+00 8.2412e-01 3.2639e-01 1.0614e-02 3.9489e-02 -6.0000e+00 8.9602e-01 -3.8527e-01 1.0322e-02 2.0570e-02 -6.0000e+00 5.3082e-01 1.6176e-01 4.9941e-03 7.3671e-03 -6.0000e+00 2.2270e-01 7.9074e-05 -8.5564e-04 1.2444e-04 8.0221e-05 -6.0000e+00 1.5668e-02 2.4582e-03 0.0000e+00 12 8 8 10 0 0 63.21 22.78 0.55 0.00246 -0.00397 21 5 1 5 0 2355.790 26.00 19.99 22.78 17.72 20.5 995.45 -141918 900000 -196829 900000 -80167 40843 -143678 -213093 -10138 12429 -214845 -104412 -152043 -83983 900000 -26245 117421 -34622 -2688 37856 -32752 -51766 345289 -53364 134991 145518 -30712 -24780 -43835 -19222 3173 -38694 22995 900000 19927 18843 -18972 16359 49489 50093 9972 12680 17609 9598 8951 21702 8802 21086 15162 2756 3200 37807 6027 17589 10142 26329 4183 3227 9528 -4805 3040 372 10256 7110 6575 -1526 5478 -731 348 4021 4752 6232 3676 -3921 -1851 -540 3530 -2584 928 -1163 -5827 -1091 547 -3342 -1932 883 107 819 298 -3830 1218 -2079 550 -526 -981 -927 -1734 62 -732 -793 -1460 -741 -883 -980 -494 310 984 -1696 -2337 -279 772 -607 -897 181 190 907 -2 663 -638 315 429 156 933 1797 409 3690 -635 1030 944 1152 485 475 89 -66 -1379 769 96 597 -284 -91 -233 -1174 -1353 -1928 900000 -5666 900000 -698 185 -2302 -7571 -53 56 -9878 -1746 -5084 -1843 900000 -503 613 -916 -56 554 -992 -1875 1563 -2156 968 988 -1145 -846 -1756 -636 99 -2237 841 900000 805 742 -1163 820 2172 2635 893 1193 1656 1003 948 2056 969 2123 1700 374 480 4517 1089 3088 2045 4704 960 745 1995 -1126 669 92 2601 2115 2109 -526 1738 -255 131 1562 2035 2755 1652 -1788 -751 -208 1209 -950 368 -521 -3224 -663 361 -2438 -1479 699 83 652 238 -3070 927 -1528 379 -379 -797 -818 -1796 68 -888 -969 -1686 -813 -878 -966 -518 341 1133 -2018 -3076 -406 1167 -992 -1484 287 286 1381 -2 998 -1028 519 695 242 1466 2695 597 5014 -872 1458 1516 1970 921 910 180 -143 -3049 1743 222 1396 -663 -201 -509 -2421 -2696 SS 20230511T105721.0Z 8531.456493 188 1 49.18 2 76.78 77.70 67.54 190.93 0.00 1 0.00 1 0 17 5.582e-01 1.257e-02 2.170e-01 3.552e-03 6.860295e-01 1.895342e-03 7.687477e-03 -6.000000e+00 3.228608e-01 230.40 -2.00 3.52 -2.00 320.66 0.00e+00 4.475010e-03 7.633929e-04 1.317676e-03 -6.000000e+00 1.431387e-02 279.92 -2.00 20.00 -2.00 320.10 0.00e+00 4.265 0.001 302.00 328.00 3 3.4612e+00 5.8368e-03 5.5373e-02 -6.0000e+00 8.0794e-01 1.8595e-01 7.6643e-03 3.9261e-02 -6.0000e+00 8.7647e-01 -1.6036e-01 7.6190e-03 1.8898e-02 -6.0000e+00 5.2126e-01 5.6588e-02 3.7563e-03 8.8799e-03 -6.0000e+00 2.2020e-01 1.2533e-04 -6.2008e-04 9.5630e-05 7.0452e-05 -6.0000e+00 1.5446e-02 2.0364e-03 0.0000e+00 12 8 8 10 0 0 32.79 22.79 0.63 0.00204 -0.00262 27 6 1 5 0 1820.970 26.00 20.00 22.79 17.91 20.5 996.64 -16850 900000 -175901 900000 -147237 163662 -120585 -191826 21229 75573 -179859 -8690 -128348 -51293 900000 -30453 60270 -80002 -33347 3459 -27925 -36968 430161 -34063 26472 61972 -31080 -27904 -39784 -24037 -4181 -21706 20729 117898 11659 6274 -20452 -5103 6643 18261 4984 -5332 3213 -2441 4682 4134 -61 8127 1255 -1147 -889 18024 -549 8003 4475 13461 346 -748 2454 3818 -55 -107 5541 3868 3742 -997 2468 -1779 2210 2382 1664 1610 1748 -2848 -3249 1475 1970 -489 654 95 -4404 -1316 -1551 -3191 -1163 498 425 815 1338 -1430 1588 314 614 -321 -457 -625 -784 711 -77 -423 -198 -352 76 -555 -114 -450 225 -1519 -971 127 569 -716 -591 67 227 -40 211 275 -239 -10 -279 -200 321 1077 24 2587 -542 1008 726 380 290 59 314 -33 -465 431 236 38 -111 -65 -233 -369 -988 -58 900000 -3400 900000 -1996 567 -1252 -4538 73 262 -4929 -48 -2925 -710 900000 -545 504 -3046 -875 67 -765 -1109 1489 -1101 504 876 -1148 -982 -1549 -853 -145 -1089 801 2078 535 295 -1351 -339 479 1417 505 -649 380 -316 574 522 -8 1050 183 -183 -157 2958 -120 1745 1078 3087 93 -204 629 944 -14 -31 1715 1275 1321 -365 858 -663 864 1070 837 850 915 -1474 -1540 597 734 -188 276 48 -2732 -908 -1097 -2436 -926 416 372 732 1193 -1264 1269 237 443 -240 -381 -606 -825 845 -101 -557 -245 -391 82 -598 -122 -511 267 -1964 -1282 185 920 -1168 -968 104 357 -60 319 433 -376 -16 -450 -329 505 1616 34 3519 -786 1407 1147 639 536 111 614 -68 -981 945 529 87 -250 -140 -498 -741 -1932 SS 20230511T110301.3Z 8531.460432 191 1 48.60 2 75.75 78.60 67.73 192.27 0.00 1 0.00 1 0 17 3.190e-01 7.750e-03 1.407e-01 2.435e-03 6.437107e-01 1.281219e-03 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