File name: Pandora179s1_CornwallCT_20240607_L2Fit_fout2c40d20221201p1-8.txt File generation date: 20240608T050339.8Z 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_20240607_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: 20240607 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 20240607T102841.3Z 8924.436589 83 1 47.97 2 79.15 69.00 84.71 57.14 0.00 1 0.00 1 0 17 5.515e-01 2.451e-02 2.573e-01 7.905e-03 7.185664e-01 4.358865e-03 8.023499e-03 -6.000000e+00 3.237947e-01 232.19 -2.00 3.52 -2.00 321.29 0.00e+00 6.898031e-03 2.085188e-03 1.083249e-03 -6.000000e+00 1.477271e-02 282.90 -2.00 20.00 -2.00 320.72 0.00e+00 5.117 0.002 302.00 328.00 3 3.6426e+00 1.4824e-02 6.3150e-02 -6.0000e+00 8.1578e-01 4.5563e-01 1.9959e-02 4.2874e-02 -6.0000e+00 8.8622e-01 -5.8333e-01 1.8415e-02 2.0169e-02 -6.0000e+00 5.2302e-01 2.4361e-01 8.6572e-03 9.9853e-03 -6.0000e+00 2.1855e-01 4.6216e-05 -2.0096e-03 2.2099e-04 9.4136e-05 -6.0000e+00 1.5389e-02 1.2039e-02 0.0000e+00 12 8 8 10 0 0 99.96 22.87 0.45 0.01204 -0.00306 31 7 1 5 0 1546.790 26.11 20.00 22.87 22.30 31.8 995.44 -103574 900000 -114177 -148245 900000 -89595 -80894 -195358 -9851 900000 -200823 -117182 -140807 198793 900000 8436 6271 24197 -14066 223823 86066 143043 900000 -63102 91629 186036 -60781 -5735 -28978 -48785 55763 -27261 48288 900000 51201 56199 -32027 27754 63868 110742 31225 38781 45020 49258 -2024 19254 10711 65772 36331 4097 17050 57953 3064 27987 15348 30703 14560 441 24376 4776 2309 170 8429 7436 10449 -3639 14199 8413 2474 3752 4731 6578 3052 -646 -3411 -775 2766 2365 -3780 669 -7616 -320 -728 -6542 1839 5231 -97 -2698 3078 -3476 2051 -2532 -1170 -27 -1835 -1011 -4758 -431 -2227 -821 -333 -1077 -726 -1691 -1566 985 155 -1554 -1327 -359 470 -850 -1445 342 -17 113 312 921 -496 -105 504 113 1193 2023 -436 5830 -484 2298 692 1621 382 -443 -192 496 -988 1140 302 1079 -581 79 -977 -1059 -1709 -1595 900000 -2512 -4484 900000 -1232 -1023 -8274 -76 900000 -10383 -2836 -5344 1531 900000 144 124 439 -402 1723 1020 1101 900000 -3124 1085 1433 -3176 -167 -1036 -2254 1156 -1454 1516 900000 1638 1631 -2202 1299 2497 3214 2095 2581 2947 3170 -219 1716 1060 4168 2997 496 1997 5036 504 3879 2549 4509 2563 89 3714 862 436 36 1854 1873 2730 -1081 3468 2235 760 1306 1806 2576 1224 -253 -1246 -246 785 680 -1293 261 -3804 -171 -430 -4343 1195 3495 -67 -1967 2267 -2636 1373 -1657 -727 -17 -1328 -791 -4506 -450 -2602 -953 -361 -1058 -644 -1506 -1492 968 162 -1778 -1667 -504 684 -1336 -2304 520 -26 167 464 1425 -774 -168 796 184 1838 2979 -632 7644 -656 3175 1101 2715 713 -893 -406 1109 -2253 2669 728 2607 -1416 183 -2264 -2295 -3602 SS 20240607T103411.4Z 8924.440410 86 1 48.45 2 78.19 69.85 83.87 57.96 0.00 1 0.00 1 0 17 4.390e-01 8.306e-03 1.367e-01 3.106e-03 6.684302e-01 1.670861e-03 7.433565e-03 -6.000000e+00 2.553460e-01 232.19 -2.00 3.52 -2.00 321.06 0.00e+00 4.216646e-03 7.670735e-04 5.902698e-04 -6.000000e+00 1.120546e-02 282.90 -2.00 20.00 -2.00 320.47 0.00e+00 4.733 0.002 302.00 328.00 3 2.5099e+00 5.5006e-03 5.7549e-02 -6.0000e+00 6.4112e-01 1.0098e-01 7.4845e-03 3.6614e-02 -6.0000e+00 6.9435e-01 -1.0247e-01 7.5225e-03 1.9287e-02 -6.0000e+00 4.1252e-01 3.1802e-02 3.6053e-03 7.8579e-03 -6.0000e+00 1.7326e-01 2.3105e-04 -9.1715e-04 8.7016e-05 7.9224e-05 -6.0000e+00 1.2000e-02 9.0482e-03 0.0000e+00 11 8 0 10 0 0 99.98 22.87 0.31 0.00905 0.00216 116 28 1 5 0 417.560 26.11 20.00 22.87 22.44 31.7 996.20 -174712 900000 -169814 -135790 -184833 -52114 -144351 -164187 -109641 -72420 -152692 -125188 -122552 -83623 34408 -50959 -6845 -50247 -7393 3291 -25463 -10700 63764 -40166 -12244 15199 -53367 5841 -28771 -168 -4433 -3680 -3182 34867 -480 -6254 -17286 -7553 9785 11588 5377 -2132 7226 7703 -2657 2900 -6551 5786 -2517 1063 3076 11871 -2309 7856 2804 5827 2526 -1984 2930 -13 2455 126 4710 2025 4230 -128 2469 2879 394 2067 1813 2110 -818 1069 -2027 310 -60 -189 -1315 -108 -1959 -1413 -1448 -3096 207 463 611 -386 766 -394 581 -324 -1003 261 -336 46 -107 893 -101 -119 -292 -984 -20 -409 -494 -1185 -134 -1215 -130 -55 449 13 -35 431 -110 307 35 590 -220 -46 -195 236 410 553 -66 525 78 820 833 -4 99 -313 102 -243 -595 12 75 416 -207 30 209 -263 -366 -1588 900000 -2011 -1159 -2392 -189 -1399 -2188 -963 -483 -2405 -1668 -2004 -1216 198 -849 -85 -1081 -114 49 -524 -191 560 -1083 -271 272 -1956 117 -802 -4 -124 -124 -125 1035 -20 -269 -901 -421 563 793 448 -208 681 749 -292 310 -792 641 -319 139 399 1589 -393 1319 529 1114 515 -425 582 -3 495 29 1162 582 1267 -40 731 874 135 800 782 953 -379 459 -822 110 -20 -63 -496 -48 -1038 -853 -963 -2226 154 366 466 -306 600 -329 448 -235 -703 186 -268 39 -105 997 -124 -147 -338 -1035 -19 -391 -507 -1298 -153 -1504 -174 -77 685 22 -57 674 -163 471 54 878 -350 -76 -318 370 616 867 -99 760 110 1201 1271 -6 188 -634 216 -511 -1340 29 180 1011 -502 70 454 -540 -790 SS 20240607T103845.5Z 8924.443583 89 1 48.88 2 77.39 70.55 83.18 58.64 0.00 1 0.00 1 0 17 4.103e-01 2.251e-02 1.793e-01 7.393e-03 6.419476e-01 4.009793e-03 7.261241e-03 -6.000000e+00 2.408305e-01 232.19 -2.00 3.52 -2.00 320.88 0.00e+00 9.652658e-03 1.672931e-03 1.918676e-03 -6.000000e+00 1.057149e-02 282.90 -2.00 20.00 -2.00 320.27 0.00e+00 4.454 0.002 302.00 328.00 3 4.2377e+00 1.2670e-02 5.7105e-02 -6.0000e+00 6.0648e-01 3.5744e-01 1.6423e-02 4.2904e-02 -6.0000e+00 6.5925e-01 -3.9219e-01 1.4942e-02 1.7804e-02 -6.0000e+00 3.8988e-01 1.6020e-01 7.2584e-03 1.2210e-02 -6.0000e+00 1.6217e-01 4.9157e-05 -2.0814e-03 2.0882e-04 9.3336e-05 -6.0000e+00 1.1300e-02 1.4878e-02 0.0000e+00 12 9 8 11 8 0 99.98 22.87 0.38 0.01488 -0.00076 28 7 1 5 0 1745.020 26.11 20.01 22.87 22.59 31.7 997.44 -118494 900000 -155922 -59063 -72899 -84337 -106628 -191486 26712 -33733 -167547 -120430 -84317 -68499 900000 -26166 51178 54446 38029 900000 22738 62936 900000 -29379 95800 83937 -62468 -5002 -6710 11459 85692 -2011 56757 900000 41200 41817 -10254 3506 49235 75805 9687 12561 20922 29713 -8104 11937 -640 28277 15549 2778 6760 44762 6847 13919 4750 19447 6367 -3277 15726 350 9041 75 4741 2937 6652 -4941 3995 2731 -1468 2932 4545 4197 2821 -670 -6315 -102 222 502 -1209 -2834 -6860 -2278 -839 -7605 1434 2935 -253 -1349 1785 -3299 2060 -2658 551 2553 -1442 1025 -3442 136 -821 -490 431 -322 -1088 -1787 377 -80 1325 -2077 -1134 -336 694 -237 -582 136 -535 -132 -173 907 -641 -1003 980 -849 1874 1817 -854 4691 -52 1585 855 406 1318 178 473 414 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