File name: Pandora64s1_NewHavenCT_20231126_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20231127T044523.2Z 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 v1.8.49 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20231126_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: 20231126 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 20231126T124829.4Z 8730.533674 298 1 47.70 2 81.95 127.22 105.55 316.22 0.00 1 0.00 1 0 25 7.023e-01 4.787e-02 1.796e-01 9.700e-03 7.432616e-01 5.480877e-03 1.104777e-02 -6.000000e+00 4.170280e-01 223.00 -2.00 3.52 -2.00 321.42 0.00e+00 6.700041e-02 2.321914e-03 5.001087e-04 -6.000000e+00 1.844105e-02 279.00 -2.00 20.00 -2.00 320.96 0.00e+00 6.683 0.005 302.00 328.00 3 2.0059e+00 1.7752e-02 9.4002e-02 -6.0000e+00 1.0259e+00 1.4288e+00 1.9932e-02 1.1557e-01 -6.0000e+00 1.1135e+00 -1.7303e+00 1.2452e-02 2.5142e-02 -6.0000e+00 6.6425e-01 7.3046e-01 6.6415e-03 5.5803e-02 -6.0000e+00 2.8438e-01 2.8591e-05 -5.4810e-03 2.6147e-04 8.5446e-04 -6.0000e+00 2.0869e-02 -3.0255e-03 -3.2750e-05 12 8 8 10 0 0 98.58 21.65 0.13 -0.00303 -0.04421 24 6 1 5 0 1987.290 26.11 19.99 21.65 5.10 35.9 927.34 208163 223777 229403 210307 -80490 75029 81468 -24881 164736 11801 -18814 39488 51798 24419 130190 144989 160693 152575 166946 175759 236407 208097 900000 136162 46316 34530 -778 -10763 56704 -33902 112191 70960 84393 124394 91378 71292 107601 82043 53698 52861 65301 50690 34230 23153 55747 84270 98246 68674 53912 27571 71825 81061 87706 41950 46971 18010 2114 -1181 18764 11917 12084 16560 37664 36911 32362 27688 19504 29384 18310 14206 10829 9483 4994 2912 -2992 -8381 11429 -10959 -9859 -305 3308 -17523 -3864 -4166 -7424 -6591 -2302 -4319 1585 1118 -6218 -3007 -14535 -11485 -11030 -5393 -5248 999 3027 1706 1968 97 -7358 -2470 -5727 -6211 -5216 1296 -3645 -1147 -528 -1105 -992 -170 -1718 -2110 1427 279 682 3596 3931 4209 4728 4673 5285 2844 -73 1815 2654 2078 1798 774 707 -279 716 -633 -1442 -1035 229 -1397 -899 -3037 4921 5158 5152 4972 -21502 3631 2696 -1592 1558 335 -656 957 1745 1589 4386 5313 5698 6402 6117 5609 3875 3673 900000 2833 1697 1224 -38 -617 1977 -3602 4045 4739 5586 5514 4914 4298 4388 4267 3713 3718 4052 3745 3066 2524 4775 6325 6910 6570 6238 4325 7711 8342 8586 6487 6453 3025 386 -208 2661 1916 2164 3298 7060 7925 7209 6313 4816 6607 4915 4373 3561 3129 1619 877 -857 -2298 2676 -3282 -3501 -120 1453 -10073 -2063 -2306 -4467 -4107 -1429 -2788 962 655 -3649 -1703 -8558 -7036 -7861 -4365 -5030 994 3196 1803 2035 91 -6767 -2175 -5547 -6315 -5659 1369 -4547 -1583 -804 -1690 -1589 -263 -2591 -3142 2127 443 1086 5964 6324 6446 6964 6635 7214 3904 -102 2721 4553 3857 3690 1713 1577 -664 1788 -1654 -3819 -2756 593 -3471 -2080 -6737 SS 20231126T130011.1Z 8730.541795 301 1 47.77 2 80.23 129.37 106.95 318.53 0.00 1 0.00 1 0 25 3.798e-01 2.563e-02 1.391e-01 6.354e-03 6.679580e-01 3.499194e-03 8.370003e-03 -6.000000e+00 2.254254e-01 223.00 -2.00 3.52 -2.00 320.98 0.00e+00 1.070805e-02 1.483521e-03 4.209225e-03 -6.000000e+00 9.969381e-03 279.00 -2.00 20.00 -2.00 320.47 0.00e+00 5.627 0.003 302.00 328.00 3 2.9384e+00 1.1109e-02 6.7239e-02 -6.0000e+00 5.5454e-01 4.6045e-01 1.3840e-02 3.7937e-02 -6.0000e+00 6.0200e-01 -5.7351e-01 1.1908e-02 2.3078e-02 -6.0000e+00 3.5912e-01 2.4196e-01 5.8682e-03 1.0158e-02 -6.0000e+00 1.5359e-01 4.7745e-05 -2.1487e-03 1.8721e-04 1.8667e-04 -6.0000e+00 1.1279e-02 -2.5015e-03 -8.3518e-05 12 9 8 11 8 0 97.59 21.60 -0.07 -0.00250 -0.01865 20 5 1 5 0 2388.280 26.11 20.01 21.60 5.52 36.0 929.43 -141134 16999 -86325 -33891 -197048 -35101 -132044 -152349 -48479 17246 -124397 8260 -67702 -42418 6998 83136 -30836 90649 -20879 64340 7828 86631 52531 99967 -19251 29141 -38759 7323 -2239 -43417 -19889 56421 13333 24165 22463 20177 9228 13152 22976 20905 24026 20076 17454 -5929 15059 17510 36638 13441 24309 -9166 29072 8772 33057 9352 21516 407 9662 6135 12596 2402 5921 8894 15137 9799 18498 -923 8586 6524 6988 2905 7166 580 1912 -2486 -1389 -5013 11110 -5549 -561 -1627 -2622 -10315 -2700 -3505 -271 -3206 564 -1123 487 -300 -2958 1962 -6020 -4904 -2456 558 -1987 1318 561 -679 -1064 -1521 -4861 -160 -3071 -3175 -1900 2145 -1194 619 1373 -29 -158 369 -660 -284 -185 412 471 1473 906 1631 1602 2557 2616 1341 -1563 1331 1487 435 412 -273 -421 -179 195 59 -1082 779 822 -261 -1245 -1937 -5829 190 -2454 -551 -12400 -503 -4764 -6659 -882 178 -4851 116 -2319 -1438 190 1305 -1380 1572 -1012 1445 285 1574 1281 1651 -933 937 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-6.0000e+00 4.4880e-01 3.3672e-01 1.3374e-02 3.5138e-02 -6.0000e+00 4.8719e-01 -3.5773e-01 1.1475e-02 1.9519e-02 -6.0000e+00 2.9063e-01 1.4192e-01 5.7381e-03 6.8279e-03 -6.0000e+00 1.2431e-01 4.3819e-05 -1.6178e-03 1.9574e-04 1.1976e-04 -6.0000e+00 9.1272e-03 -2.8075e-03 -6.9835e-05 12 9 8 11 32 0 99.12 21.59 -0.08 -0.00281 -0.01496 14 3 1 5 0 3442.770 26.11 20.01 21.59 5.77 36.1 930.47 -140029 -82523 -99584 -64419 -39679 -94853 -84577 -150700 -49120 -50027 -97109 -17504 -48354 -72453 -21399 -7408 -26618 30114 -12233 6556 11734 39967 88320 9843 7264 -6174 -32035 -15795 -359 -64826 14245 -1735 12862 -856 23908 24520 26366 -9492 7639 7997 15977 3816 19513 -20843 12728 15433 19783 -1258 8888 -16083 19552 5425 26699 7063 7842 3143 8279 710 5100 4313 4063 6816 5360 8882 13425 -60 3462 6320 3744 3357 5514 4188 -837 -1309 -481 -3811 4028 -1643 -4001 504 -3243 -10003 -1565 -2784 -2739 -3314 102 1703 2134 1393 -2581 -25 -4803 -3325 -1946 1213 -1389 898 4 -808 -961 -1599 -3058 -849 -1278 -2456 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