File name: Pandora179s1_CornwallCT_20241213_L2Fit_fout2c40d20221201p1-8.txt File generation date: 20241214T045219.3Z 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 v1.8.60 Instrument operation file used: Pandora179_OF_v3d20220331.txt Instrument calibration file used: Pandora179s1_CF_v40d20221201.txt Level 1 file used: Pandora179s1_CornwallCT_20241213_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: 20241213 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 20241213T124855.2Z 9113.533973 253 1 47.50 2 85.23 127.23 109.10 328.92 0.00 1 0.00 1 0 33 7.285e-01 8.574e-02 3.549e-01 3.049e-02 1.317073e+00 1.828997e-02 1.488821e-02 -6.000000e+00 4.195495e-01 222.43 -2.00 3.52 -2.00 322.19 0.00e+00 -2.024291e-02 5.967743e-03 3.675970e-03 -6.000000e+00 1.992101e-02 273.58 -2.00 20.00 -2.00 321.59 0.00e+00 10.199 0.020 302.00 328.00 3 -3.0954e-01 5.7140e-02 1.1686e-01 -6.0000e+00 1.0348e+00 3.2133e+00 7.0231e-02 6.5180e-02 -6.0000e+00 1.1370e+00 -2.9411e+00 4.6788e-02 3.8536e-02 -6.0000e+00 6.7048e-01 8.9970e-01 2.5629e-02 1.6881e-02 -6.0000e+00 2.8317e-01 7.3574e-06 1.2618e-03 6.9642e-04 2.3688e-04 -6.0000e+00 2.0238e-02 1.6392e-02 0.0000e+00 12 8 8 10 0 0 15.50 22.75 1.14 0.01639 0.02587 22 5 1 5 0 2158.650 26.00 20.00 22.75 -3.12 32.2 864.64 189938 900000 68721 148789 84677 57073 94709 -25048 102164 900000 -52671 37962 -16977 63833 900000 115698 189761 88921 267541 177350 119786 900000 900000 -18681 900000 900000 14189 38095 -23454 13184 45218 -12091 84167 900000 217810 900000 -47310 140895 127518 900000 22124 107184 165597 107884 2261 -18964 -5808 900000 75422 50739 57849 900000 -19367 92302 12586 900000 40090 -409 -11711 253356 1047 -40990 122960 25931 148331 -93637 123279 7098 22731 56152 61706 81587 60335 27382 -14502 64351 86907 -34358 23754 36298 -31418 13193 57383 -7916 53492 127257 48595 5388 59583 -32887 50692 -32714 22026 40787 19339 25119 16627 10495 -5444 3734 -5510 3796 11797 -2433 10644 33269 46003 -5255 1383 1447 18451 -5052 -2191 1186 2512 -1097 -10422 1759 -3521 -1219 1147 -10443 1314 7725 -11775 31361 -9252 -978 3348 2665 1953 -8368 -1094 -2094 1133 3542 377 1851 1668 938 -1772 1119 -2909 7510 900000 7642 5883 4813 3667 4213 -3962 4797 900000 -11715 3565 -3063 5679 900000 7798 6139 7671 7934 5259 5490 900000 900000 -3324 900000 900000 1721 2978 -2845 1102 3169 -1728 4992 900000 6459 900000 -8163 4178 5157 900000 3221 6646 5357 5526 293 -2761 -705 900000 4270 3967 4679 900000 -4020 6719 2138 900000 5296 -75 -2084 7513 130 -8067 5834 3356 6598 -42662 7312 1320 4045 8826 9698 10404 8767 4791 -2932 5534 5670 -8151 3733 6135 -11350 3912 12082 -3052 12691 14718 12393 2077 12722 -14895 10072 -14455 5879 10281 7284 10801 9270 6592 -4373 2708 -3996 2364 5877 -1356 5461 14207 18417 -3912 1132 1299 16514 -6388 -2841 1502 3081 -1372 -14582 2267 -4927 -1636 1394 -13064 1527 8201 -13491 25110 -11249 -1256 4622 4469 3822 -20325 -2722 -5768 3262 10342 1145 5524 4822 2514 -4381 2437 -6431 SS 20241213T130008.6Z 9113.541767 256 1 48.70 2 83.59 129.23 110.07 331.32 0.00 1 0.00 1 0 25 5.828e-01 2.320e-02 3.038e-01 7.617e-03 1.145282e+00 4.441217e-03 1.216800e-02 -6.000000e+00 3.311020e-01 222.43 -2.00 3.52 -2.00 322.46 0.00e+00 7.407959e-03 2.521875e-03 1.180328e-02 -6.000000e+00 1.568410e-02 273.58 -2.00 20.00 -2.00 322.06 0.00e+00 8.115 0.010 302.00 328.00 3 2.8788e-01 1.6890e-02 1.2424e-01 -6.0000e+00 8.1657e-01 1.5718e+00 2.4095e-02 1.2440e-01 -6.0000e+00 8.9612e-01 -1.9784e+00 2.3697e-02 5.1320e-02 -6.0000e+00 5.3027e-01 7.7548e-01 1.1095e-02 1.2675e-02 -6.0000e+00 2.2327e-01 5.3602e-05 -1.7394e-03 1.8640e-04 2.2204e-04 -6.0000e+00 1.6012e-02 1.5862e-02 0.0000e+00 12 8 8 10 0 0 0.36 22.75 0.46 0.01586 0.00279 76 18 1 5 0 640.690 25.90 19.99 22.75 -2.11 32.3 870.99 32657 900000 -17610 17959 -90384 31272 -143900 -114909 -37930 900000 -180728 13837 -128105 -42775 900000 -52595 57255 -35104 199088 79072 900000 43083 900000 -16796 900000 900000 -91134 96834 -51822 32151 -19064 -31446 11472 900000 103542 88257 -8356 13561 67964 342597 28045 21210 143661 67253 23715 5858 -1459 115013 37056 21419 34475 163679 20646 93545 37379 138769 49262 16603 20876 43179 37842 -7163 46778 19668 55787 -11205 37102 19706 13593 30004 27159 27797 22327 19320 7250 12251 5858 4627 8320 6389 -1435 5889 7794 -373 8753 9304 7204 -1780 10919 -4369 72 -4770 143 2948 -3095 -1632 -4626 -319 -3735 -1705 -3252 -2564 -1562 -4822 -2148 -642 2683 -4803 -2230 -2183 347 -2824 -1404 -784 -993 -863 -1901 562 -31 868 1230 1531 2495 3712 291 5051 1221 240 1076 -211 1441 -1011 216 173 564 750 602 697 79 -409 -869 -845 -2471 286 900000 -285 182 -2194 232 -4657 -2712 -409 900000 -7799 103 -4578 -865 900000 -1809 734 -1207 1477 853 900000 552 900000 -374 900000 900000 -3933 718 -1328 390 -488 -1145 317 900000 1229 1113 -254 366 1361 2541 964 815 1811 1796 950 278 -76 1962 1484 1096 1739 2549 1470 3469 2551 3499 3033 1355 1502 2306 2105 -680 3019 1955 4262 -1712 3605 2441 1996 4273 4331 4495 3643 2923 1076 1508 730 628 1302 1270 -341 1529 2223 -123 2762 3049 2487 -681 3615 -1605 24 -1570 50 1012 -1352 -861 -3044 -239 -3236 -1470 -2657 -1820 -959 -2949 -1350 -419 1809 -3860 -2021 -2361 430 -4028 -2075 -1159 -1439 -1225 -2780 841 -49 1363 1826 2104 3223 4600 364 5875 1469 323 1735 -377 2911 -2319 532 463 1488 2056 1667 1930 216 -1128 -2178 -1920 -5457 SS 20241213T131043.4Z 9113.549113 259 1 48.57 2 82.08 131.15 110.91 333.62 0.00 1 0.00 1 0 17 9.499e-01 1.242e-02 2.653e-01 3.347e-03 1.025786e+00 1.875386e-03 1.079807e-02 -6.000000e+00 5.325480e-01 222.43 -2.00 3.52 -2.00 322.09 0.00e+00 6.976157e-03 1.034759e-03 5.266260e-03 -6.000000e+00 2.336205e-02 273.58 -2.00 20.00 -2.00 321.68 0.00e+00 6.791 0.006 302.00 328.00 3 4.4621e-01 6.8017e-03 9.1910e-02 -6.0000e+00 1.3108e+00 4.9514e-01 1.1907e-02 7.9091e-02 -6.0000e+00 1.4320e+00 -6.2317e-01 1.4226e-02 3.6624e-02 -6.0000e+00 8.5296e-01 2.4406e-01 6.3527e-03 1.3376e-02 -6.0000e+00 3.6290e-01 2.0227e-04 -1.1329e-03 8.1965e-05 1.4816e-04 -6.0000e+00 2.5902e-02 1.5637e-02 0.0000e+00 12 8 8 10 0 0 4.69 22.75 0.44 0.01564 0.00712 162 39 1 5 0 299.760 26.00 20.00 22.75 -1.15 32.2 875.56 -227477 900000 -307462 -257442 -344305 -149362 -298181 -319121 -309205 -221448 -354333 -221626 -258674 -211357 57459 -146835 -161760 -156584 -34298 -84249 -13862 -106047 900000 -126777 -58824 -25145 -127028 -87644 -109354 -40808 -52777 -17492 -31710 256569 -32660 11777 -40976 -18146 26407 39124 13253 -2962 24178 3329 -2194 -5455 -14896 15692 10656 6804 7832 34804 -414 22907 14470 25705 14226 9678 6915 9818 10588 3354 14886 8722 13407 -1834 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