File name: Pandora179s1_CornwallCT_20231116_L2Fit_fout2c40d20221201p1-8.txt File generation date: 20240124T083531.9Z 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_20231116_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: 20231116 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 20231116T122814.9Z 8720.519617 61 1 48.87 2 83.54 122.36 119.22 103.79 0.00 1 0.00 1 0 17 6.269e-01 2.839e-02 2.733e-01 9.888e-03 1.028876e+00 5.790954e-03 1.150171e-02 -6.000000e+00 3.634990e-01 222.80 -2.00 3.52 -2.00 322.31 0.00e+00 9.244792e-03 3.279971e-03 1.587309e-02 -6.000000e+00 1.688676e-02 276.72 -2.00 20.00 -2.00 321.89 0.00e+00 8.065 0.010 302.00 328.00 3 9.5426e-01 2.2210e-02 1.3710e-01 -6.0000e+00 8.9819e-01 1.4395e+00 2.8905e-02 1.4382e-01 -6.0000e+00 9.8683e-01 -1.8664e+00 2.5005e-02 4.5601e-02 -6.0000e+00 5.8143e-01 7.4638e-01 1.1925e-02 1.4045e-02 -6.0000e+00 2.4309e-01 3.3050e-05 -2.6657e-03 2.6118e-04 2.2019e-04 -6.0000e+00 1.7536e-02 8.6283e-03 0.0000e+00 12 8 8 10 0 0 14.10 22.60 0.74 0.00863 -0.01140 44 11 1 5 0 1110.550 25.79 19.99 22.60 10.98 27.0 925.78 1838 900000 -76390 -25611 -20344 -79200 900000 -138598 900000 -39123 -104555 -112144 -74958 -61004 900000 -3300 900000 69345 27715 900000 35197 900000 900000 53338 900000 900000 -19641 41813 -10106 -37971 900000 -65498 203411 900000 382164 67828 -4135 40868 61932 169300 57261 104829 84297 129401 13614 51578 -38933 185569 67461 32438 49780 203119 44625 43368 82616 144398 46511 5164 60247 25998 28613 17049 45269 36098 12538 22119 27183 38874 7246 23903 24219 24506 18573 171 15959 2488 31295 -358 21397 1766 -10896 -1740 9051 -6270 4043 17790 3835 7589 3902 3448 122 -3847 -8857 4483 -1883 -3249 -5646 -3505 -1527 -3171 -40 -3256 2194 -3666 -1956 766 326 -6476 -6390 -2145 -1451 -2194 -2005 -1547 -1091 -644 -1519 554 517 405 3778 -1571 3435 3869 593 7280 133 2357 1006 989 -8 1846 614 668 -1347 1685 -50 777 -316 -982 -715 -1131 -2199 37 900000 -3808 -694 -427 -2494 900000 -6909 900000 -684 -3383 -4119 -2360 -2187 900000 -101 900000 1213 751 900000 800 900000 900000 840 900000 900000 -584 622 -239 -1262 900000 -4353 1957 900000 3676 1370 -171 1179 1668 1792 2038 2420 2433 2365 773 1985 -3745 1964 2466 1810 2586 2540 2962 3129 4212 4028 3445 556 3478 1976 2092 1509 3484 3542 1713 2788 3295 4413 1241 3955 4380 4550 3538 36 2502 390 3432 -57 3170 393 -3323 -568 2969 -2551 1564 6298 1620 3146 1663 1416 48 -1503 -3621 1734 -911 -1756 -3763 -2707 -1298 -2804 -32 -2404 1347 -2299 -1274 514 234 -5448 -6125 -2320 -1816 -3071 -2928 -2253 -1539 -883 -2130 798 784 627 5455 -2244 4437 4833 744 8322 161 3013 1548 1802 -15 3844 1398 1639 -3621 4606 -141 2181 -883 -2597 -1722 -2499 -4674 SS 20231116T123849.5Z 8720.526962 64 1 48.44 2 81.90 124.26 117.40 105.24 0.00 1 0.00 1 0 17 7.307e-01 1.394e-02 1.912e-01 3.549e-03 8.811699e-01 1.929651e-03 9.593834e-03 -6.000000e+00 4.104237e-01 222.80 -2.00 3.52 -2.00 321.83 0.00e+00 8.395908e-03 1.055467e-03 2.496116e-03 -6.000000e+00 1.803592e-02 276.72 -2.00 20.00 -2.00 321.38 0.00e+00 6.653 0.005 302.00 328.00 3 8.5515e-01 6.9381e-03 8.1001e-02 -6.0000e+00 1.0102e+00 4.3353e-01 1.0584e-02 5.7979e-02 -6.0000e+00 1.1027e+00 -5.7276e-01 1.1747e-02 2.6985e-02 -6.0000e+00 6.5726e-01 2.2857e-01 5.3870e-03 1.3144e-02 -6.0000e+00 2.7844e-01 1.7733e-04 -1.2563e-03 9.0468e-05 1.3886e-04 -6.0000e+00 1.9905e-02 8.3378e-03 0.0000e+00 12 8 8 10 0 0 22.21 22.60 0.42 0.00834 -0.00110 121 29 1 5 0 400.250 25.79 20.01 22.60 12.22 27.1 933.20 -235417 -129474 -164878 -253423 -213497 -248364 -203380 -297368 -133835 -189097 -269475 -223707 -216019 -110357 -84554 -40148 -101282 -72890 -77116 13134 -79248 -75584 -17045 -85643 35318 -32839 -65009 -52069 -51806 -79253 16320 -54986 -14949 90245 -12475 31589 -39342 7339 -14508 37846 6928 32214 16040 17986 11233 4406 -4678 8226 15929 -1904 26085 27468 4324 14083 16927 24046 11265 10571 7108 11717 7469 11439 8705 14467 9190 4778 9035 5244 5160 5920 7738 3113 6335 423 3555 -1316 576 -890 697 588 -2655 153 -1248 -1443 499 2189 -217 -56 1380 -426 1200 -1479 -846 -454 -693 -1729 -1090 -639 -80 -801 -880 -1324 -1062 -914 -2016 -1476 -556 -1747 -1542 -666 -129 -177 -149 -474 -44 -194 419 -25 426 -62 594 496 1025 1084 512 2219 49 1256 503 646 290 521 41 81 -489 117 40 212 -198 -386 256 -543 -952 -2074 -489 -986 -3668 -1881 -2891 -1536 -6175 -590 -1547 -5172 -3097 -3670 -993 -790 -306 -1683 -1034 -1254 91 -1399 -1256 -159 -1690 220 -421 -1170 -811 -807 -1810 181 -1580 -347 812 -307 481 -1294 175 -522 969 276 1081 672 766 521 226 -274 450 871 -136 1598 1892 418 1355 1693 2330 1271 1189 795 1213 825 1342 1223 2238 1644 906 1664 1058 1157 1522 2167 866 1844 122 890 -308 124 -204 182 188 -957 62 -577 -713 257 1174 -125 -33 798 -241 625 -749 -419 -239 -423 -1271 -946 -646 -82 -833 -937 -1259 -899 -758 -1801 -1387 -549 -1901 -1725 -853 -187 -280 -240 -758 -67 -288 624 -39 702 -104 969 767 1509 1544 709 2928 65 1760 828 1231 575 1118 94 201 -1209 301 104 559 -518 -956 628 -1245 -2113 SS 20231116T124858.7Z 8720.534012 67 1 48.52 2 80.36 126.12 115.67 106.63 0.00 1 0.00 1 0 17 6.047e-01 8.736e-03 8.734e-02 1.821e-03 7.707426e-01 9.681823e-04 8.546555e-03 -6.000000e+00 3.396469e-01 222.80 -2.00 3.52 -2.00 321.34 0.00e+00 4.907348e-03 4.705833e-04 9.795462e-04 -6.000000e+00 1.492525e-02 276.72 -2.00 20.00 -2.00 320.86 0.00e+00 5.699 0.003 302.00 328.00 3 7.7218e-01 3.2125e-03 6.7349e-02 -6.0000e+00 8.3601e-01 1.7138e-01 4.6735e-03 4.2917e-02 -6.0000e+00 9.1256e-01 -2.1896e-01 5.1406e-03 2.2457e-02 -6.0000e+00 5.4390e-01 8.1376e-02 2.4288e-03 9.7086e-03 -6.0000e+00 2.3044e-01 5.2147e-04 -9.6264e-04 4.8325e-05 1.0094e-04 -6.0000e+00 1.6471e-02 7.7907e-03 0.0000e+00 11 8 0 10 0 0 8.16 22.62 0.35 0.00779 0.00056 222 53 1 5 0 218.520 25.79 20.00 22.62 13.31 27.2 939.21 -178785 -150619 -151947 -224270 -172234 -218740 -202532 -219525 -191551 -126802 -211823 -159034 -156314 -87683 -51298 -71063 -71908 -66320 -55009 -47530 -45436 -55421 -13151 -65088 -11939 -36183 -56143 -44066 -50442 -52498 -25155 -27608 -24110 10825 -10474 -4737 -25150 -4733 -7616 40 2216 2927 6416 431 3878 2097 -406 4354 4601 2545 4762 8848 2870 7631 3987 8585 3597 2868 2795 4492 2881 3456 5751 5717 5057 2465 4092 1511 1954 2164 2715 1890 2008 273 -197 15 -405 -604 -1022 -563 -1595 -373 -1761 -1884 -940 -378 37 -68 840 288 590 -221 -276 -230 -237 -467 -375 669 -67 -188 -449 -735 -503 -357 -1109 -1481 -919 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