File name: Pandora64s1_NewHavenCT_20240719_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240720T050621.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240719_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20240719 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 20240719T102124.9Z 8966.431538 135 1 47.76 2 83.01 68.50 122.63 258.44 0.00 1 0.00 1 0 25 5.252e-01 3.112e-02 3.114e-01 1.222e-02 9.457114e-01 7.292339e-03 1.164254e-02 -6.000000e+00 3.226515e-01 232.79 -2.00 3.52 -2.00 322.07 0.00e+00 2.317547e-02 4.156247e-03 2.305539e-03 -6.000000e+00 1.441007e-02 289.44 -2.00 20.00 -2.00 321.54 0.00e+00 7.528 0.008 302.00 328.00 3 1.3111e+00 2.8751e-02 9.2361e-02 -6.0000e+00 8.0927e-01 1.5005e+00 3.5058e-02 6.0868e-02 -6.0000e+00 8.7153e-01 -1.7957e+00 2.3815e-02 2.7032e-02 -6.0000e+00 5.1905e-01 6.9193e-01 1.1804e-02 2.2878e-02 -6.0000e+00 2.1913e-01 2.3349e-05 -2.8865e-03 3.2899e-04 4.2014e-04 -6.0000e+00 1.5649e-02 1.1713e-02 -1.8321e-04 12 8 8 10 0 0 -30.90 21.79 0.51 0.01171 -0.00998 30 7 1 5 0 1591.580 26.21 20.00 21.79 24.74 39.9 1025.73 -22811 52280 16825 -56312 -61220 693 -77930 -37114 58016 41566 -93127 11137 -5854 -41040 66741 -8575 -7307 119139 25662 26378 149565 208046 167627 7645 24357 -5730 87433 -18563 64009 -109604 4925 -10427 212719 22929 153465 -20735 79574 2738 37150 9885 73996 53928 98484 -24116 54115 17414 172166 37512 53413 -28507 77034 -9523 180691 20999 87802 31820 35111 3039 56605 27803 27784 37938 43362 29809 54386 16008 8434 28550 22436 11282 15378 18966 14253 12815 -4834 -6798 34767 1379 -10831 9176 -1570 -463 -404 -1384 2009 6371 3126 -655 3382 5364 -7161 559 -12167 -4763 -9787 3405 -2539 2106 -1607 -2554 -2547 -2979 -8551 -1848 -5205 -4446 -3794 5087 -3673 982 445 -945 -265 -15 -1027 -2327 -658 -1094 -34 2501 1009 3648 1409 2639 4093 1301 -1801 1066 2048 915 956 -1526 -273 -156 1392 -531 627 557 1868 -795 -952 -3292 -1112 1246 547 -3172 -2984 16 -3461 -1005 691 495 -3934 205 -171 -2223 1518 -474 -427 2065 1112 1086 1782 2479 1997 265 660 -199 1250 -684 1220 -13059 235 -666 2535 1118 2011 -1393 2275 169 1992 685 3086 2827 3403 -2586 2966 1283 3077 2726 3500 -4169 4773 -1372 4521 2457 5754 3274 3385 382 4384 2620 2799 3904 4838 4262 6244 2688 1590 4639 4350 2701 3665 4314 3165 2610 -1042 -1370 4670 287 -3074 2564 -568 -188 -175 -639 949 2995 1565 -313 1659 2440 -3475 245 -6221 -2543 -5986 2177 -2024 1838 -1535 -2394 -2200 -2295 -6495 -1360 -4207 -3744 -3459 4702 -4256 1250 637 -1336 -377 -23 -1525 -3496 -1013 -1637 -52 3762 1596 5339 2047 3651 5463 1752 -2544 1661 3417 1760 2048 -3613 -686 -421 3660 -1462 1721 1537 4935 -2168 -2422 -8040 SS 20240719T103207.8Z 8966.438980 138 1 48.47 2 81.13 70.17 124.51 259.90 0.00 1 0.00 1 0 25 4.881e-01 2.430e-02 1.820e-01 4.098e-03 8.196891e-01 2.407058e-03 1.115269e-02 -6.000000e+00 2.997961e-01 232.79 -2.00 3.52 -2.00 321.67 0.00e+00 2.090322e-02 1.369652e-03 8.994684e-03 -6.000000e+00 1.338981e-02 289.44 -2.00 20.00 -2.00 321.12 0.00e+00 6.130 0.004 302.00 328.00 3 1.3366e+00 9.1773e-03 8.2579e-02 -6.0000e+00 7.5195e-01 5.7725e-01 1.2318e-02 5.5670e-02 -6.0000e+00 8.0980e-01 -7.6373e-01 1.0938e-02 3.3808e-02 -6.0000e+00 4.8229e-01 3.0970e-01 5.0891e-03 1.5206e-02 -6.0000e+00 2.0360e-01 1.1891e-04 -1.9919e-03 1.1445e-04 3.6976e-04 -6.0000e+00 1.4541e-02 1.1885e-02 -1.8382e-04 12 9 8 11 8 0 -11.93 21.81 0.23 0.01189 -0.00308 83 20 1 5 0 583.850 26.21 20.00 21.81 25.10 39.8 1027.30 -67255 -45182 80265 -165967 -301512 -153824 -130845 -155912 -103540 -151014 -145983 -109417 -51397 -66457 -21104 8472 -1883 -23616 9886 36646 12989 53220 117934 3671 15302 -13842 -41608 -19796 -27431 -54752 -18761 19347 24482 50810 33917 18387 29581 6863 26139 16969 46584 25905 37069 15780 20376 35046 37267 32451 18783 8970 29448 38200 38475 22845 24075 18190 12483 12314 17594 14407 13972 18554 19385 23179 22360 12630 12598 13686 11179 8536 8124 8918 4083 3486 -282 1016 5589 -2542 705 2760 -1295 -560 -1475 -3214 -1602 -1940 -891 -1017 255 -134 -2556 -2759 -5354 -3923 -3000 -2113 -2665 -327 38 -1159 -621 -3335 -3742 -1784 -1641 -3496 -1791 -1326 -1040 -229 391 -553 136 -133 -283 -1090 946 489 1786 1379 1294 1385 1849 1553 2504 1322 -608 1105 1676 576 893 -34 -266 -494 542 -389 -836 337 343 -538 -235 -1835 -464 -279 321 -3196 -18575 -2235 -1474 -2266 -993 -2140 -2121 -1431 -575 -1062 -304 108 -30 -472 162 469 202 532 613 59 214 -260 -1031 -403 -669 -1969 -600 549 685 1198 895 588 934 284 1035 826 1811 1318 1791 975 1258 1961 2153 2110 1501 870 2621 3414 3704 2730 2886 2339 1687 1619 2160 1879 1995 2892 3157 4068 4058 2523 2622 2990 2844 2487 2497 2729 1243 983 -75 245 1301 -707 228 1044 -592 -266 -756 -1777 -931 -1186 -559 -644 157 -79 -1447 -1516 -3073 -2467 -2194 -1806 -2476 -338 41 -1221 -601 -3203 -3415 -1671 -1632 -3453 -1886 -1526 -1352 -335 583 -865 211 -201 -414 -1599 1415 770 2911 2257 2044 2088 2889 2335 3641 1898 -899 1682 2921 1138 1815 -75 -622 -1166 1348 -1005 -2195 881 872 -1296 -565 -4233 SS 20240719T104431.6Z 8966.447588 143 1 48.35 2 78.93 72.08 126.70 261.61 0.00 1 0.00 1 0 25 4.970e-01 1.051e-02 6.653e-02 1.738e-03 7.068038e-01 9.893024e-04 8.061303e-03 -6.000000e+00 3.053859e-01 232.79 -2.00 3.52 -2.00 321.03 0.00e+00 3.124424e-03 4.735702e-04 1.476388e-03 -6.000000e+00 1.363164e-02 289.44 -2.00 20.00 -2.00 320.39 0.00e+00 5.020 0.002 302.00 328.00 3 1.2367e+00 3.3616e-03 6.3380e-02 -6.0000e+00 7.6598e-01 7.1082e-02 4.5262e-03 3.8814e-02 -6.0000e+00 8.2483e-01 -1.1243e-01 4.2901e-03 2.0432e-02 -6.0000e+00 4.9125e-01 3.9031e-02 2.0528e-03 6.8467e-03 -6.0000e+00 2.0745e-01 4.8044e-04 -8.8274e-04 5.0368e-05 9.2001e-05 -6.0000e+00 1.4802e-02 1.0826e-02 -1.3278e-04 12 8 8 10 0 0 1.33 21.83 0.21 0.01083 0.00419 188 45 1 5 0 257.160 26.21 20.00 21.83 25.47 39.9 1028.98 -111427 -175519 -131214 -171047 -276270 -186584 -151537 -153152 -110959 -124783 -109679 -129478 -76984 -88095 -55883 -50484 -38641 -30425 -31229 -38123 -26301 -17730 -11604 -19082 -20888 -15084 -20982 -22476 -12074 -34067 -7164 -4233 5938 -6065 -4655 -6289 -3067 -3644 -925 1769 7174 5041 7572 3084 6900 6118 6992 6741 4322 2906 5786 4073 6162 4757 2704 3100 1324 1696 2536 2720 2269 3069 4379 5228 3203 944 693 865 2142 2722 867 1366 -85 715 -637 -835 -402 -2350 -998 306 -1621 -1122 -2153 -2103 -963 -421 182 260 1299 353 31 434 -825 -488 204 -7 -620 822 384 -687 -644 -1811 -1952 170 27 -1763 -399 -503 -211 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