File name: Pandora166s1_PhiladelphiaPA_20231213_L2Fit_fout2c6d20231015p1-8.txt File generation date: 20241031T034654.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 166 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora166_OF_v5d20210217.txt Instrument calibration file used: Pandora166s1_CF_v6d20231015.txt Level 1 file used: Pandora166s1_PhiladelphiaPA_20231213_L1_smca1c6d20231015p1-8.txt Full location name: Philadelphia, Pennsylvania; Philadelphia-Camden-Wilmington; North East Waste (NE Short location name: PhiladelphiaPA Country of location: United States Location latitude [deg]: 39.9919 Location longitude [deg]: -75.0811 Location altitude [m]: 6 Local noon date: 20231213 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0440 305.1847 305.3255 305.4662 305.6069 305.7476 305.8882 306.0289 306.1696 306.3102 306.4509 306.5915 306.7321 306.8727 307.0133 307.1539 307.2945 307.4350 307.5756 307.7161 307.8566 307.9972 308.1377 308.2781 308.4186 308.5591 308.6996 308.8400 308.9804 309.1209 309.2613 309.4017 309.5421 309.6825 309.8228 309.9632 310.1035 310.2439 310.3842 310.5245 310.6648 310.8051 310.9454 311.0857 311.2259 311.3662 311.5064 311.6466 311.7869 311.9271 312.0672 312.2074 312.3476 312.4878 312.6279 312.7680 312.9082 313.0483 313.1884 313.3285 313.4685 313.6086 313.7487 313.8887 314.0288 314.1688 314.3088 314.4488 314.5888 314.7288 314.8687 315.0087 315.1486 315.2886 315.4285 315.5684 315.7083 315.8482 315.9881 316.1279 316.2678 316.4076 316.5475 316.6873 316.8271 316.9669 317.1067 317.2465 317.3862 317.5260 317.6657 317.8055 317.9452 318.0849 318.2246 318.3643 318.5040 318.6436 318.7833 318.9229 319.0626 319.2022 319.3418 319.4814 319.6210 319.7606 319.9001 320.0397 320.1792 320.3188 320.4583 320.5978 320.7373 320.8768 321.0163 321.1557 321.2952 321.4346 321.5740 321.7135 321.8529 321.9923 322.1317 322.2710 322.4104 322.5497 322.6891 322.8284 322.9677 323.1070 323.2463 323.3856 323.5249 323.6642 323.8034 323.9426 324.0819 324.2211 324.3603 324.4995 324.6387 324.7778 324.9170 --------------------------------------------------------------------------------------- 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 20231213T130845.7Z 8747.547751 72 1 28.98 2 82.12 129.35 91.55 127.28 0.00 1 0.00 1 0 25 5.185e-01 3.445e-02 3.961e-01 2.505e-02 8.582439e-01 1.439956e-02 9.296548e-03 -6.000000e+00 2.986773e-01 223.00 -2.00 3.49 -2.00 321.96 0.00e+00 2.465704e-03 5.831105e-03 1.014726e-03 -6.000000e+00 1.287641e-02 278.21 -2.00 20.00 -2.00 321.60 0.00e+00 6.813 0.006 302.00 328.00 3 2.0462e+00 4.5350e-02 8.1040e-02 -6.0000e+00 7.4054e-01 1.0544e+00 5.7300e-02 4.4537e-02 -6.0000e+00 8.1103e-01 -1.4463e+00 5.3521e-02 2.4873e-02 -6.0000e+00 4.7562e-01 6.0751e-01 2.8003e-02 8.5895e-03 -6.0000e+00 2.0267e-01 2.9662e-05 -1.8318e-03 7.2698e-04 1.2151e-04 -6.0000e+00 1.5517e-02 6.5078e-03 0.0000e+00 12 9 9 12 1 1 99.96 19.38 0.44 0.00651 -0.00726 11 4 1 5 0 2414.760 26.21 19.98 19.38 9.38 22.6 911.88 900000 31960 -57473 900000 63268 900000 -78706 900000 -131115 -135009 -31547 -77503 900000 34737 900000 53676 900000 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4200 1169 4447 1649 4892 5177 2843 3627 -2219 4051 1307 1562 -810 6553 2262 599 2988 -1341 4955 3145 2802 2980 3295 5130 3119 3661 5041 -1013 1245 341 673 -1257 2900 -3397 1100 1931 2510 -7418 -1358 4809 662 -5015 -6526 -2696 -4301 -4616 374 -14 351 -3618 -3046 -4451 -2724 -1888 -6131 -3102 -1883 2615 -4015 211 1424 -631 1285 -4063 5764 -3386 2551 -334 995 2326 1554 2714 3539 4711 15 6071 4012 2241 1402 -1490 80 -170 1961 -3276 2304 -765 -1879 7727 -4551 -692 -3839 -3022 SS 20231213T132035.0Z 8747.555961 75 1 28.49 2 80.40 131.48 89.84 129.11 0.00 1 0.00 1 0 17 5.254e-01 2.317e-02 3.749e-01 1.632e-02 7.520180e-01 9.110275e-03 8.171568e-03 -6.000000e+00 3.029989e-01 223.00 -2.00 3.49 -2.00 321.65 0.00e+00 3.371068e-03 3.740207e-03 8.752328e-04 -6.000000e+00 1.422366e-02 278.21 -2.00 20.00 -2.00 321.30 0.00e+00 5.720 0.003 302.00 328.00 3 2.7581e+00 2.8427e-02 6.9030e-02 -6.0000e+00 7.5168e-01 3.9667e-01 3.9021e-02 3.9552e-02 -6.0000e+00 8.2553e-01 -5.2598e-01 4.3478e-02 2.2323e-02 -6.0000e+00 4.8331e-01 2.1946e-01 2.1575e-02 7.6879e-03 -6.0000e+00 2.0398e-01 4.9743e-05 -1.0529e-03 4.8950e-04 1.0365e-04 -6.0000e+00 1.4830e-02 4.5564e-03 0.0000e+00 12 9 9 12 9 1 99.90 19.38 0.20 0.00456 -0.00336 11 4 1 5 0 2373.570 26.21 19.99 19.38 10.54 22.6 921.72 900000 -233610 -158734 900000 -156996 900000 -170744 -201549 900000 27466 -164533 900000 -106312 -55129 6576 -94197 900000 140981 -77117 900000 113917 4350 160413 -15190 900000 900000 14127 -28099 -49034 80038 35419 900000 68710 34860 88242 -8727 90801 9099 32441 98911 30090 14426 -35408 51215 14796 -2149 -7974 52117 -797 16431 12789 19348 27429 -813 18713 11882 24371 -4533 5987 19107 -5100 28910 5514 16857 9105 15607 7719 8169 13593 -5589 6378 7764 5631 2600 733 12649 -9255 7973 -9262 -5929 7291 1998 -1641 -3448 66 77 3799 -1676 -1151 1650 1381 -2489 -948 -3109 2732 1227 -1678 -3367 -2594 -767 2341 -944 1345 -2899 -2582 -211 -2445 -528 -4251 889 670 -1463 -1555 -2815 857 -262 1417 -804 -1065 479 986 2576 1812 1797 -6 2046 265 5235 -908 375 2071 -1042 355 666 -279 139 1012 640 -271 -898 389 -2182 -1050 900000 -8632 -3274 900000 -2827 900000 -3420 -5699 900000 436 -4055 900000 -2146 -898 104 -3105 900000 2240 -2840 900000 1810 82 2548 -366 900000 900000 294 -815 -1671 1272 727 900000 1431 1041 1621 -358 1683 386 1331 2679 1638 959 -3836 2634 1052 -180 -718 2865 -73 1378 1218 1933 2787 -116 2356 1649 3089 -746 867 2388 -808 3632 971 3023 1884 3038 1605 1747 3016 -1696 1912 2406 1767 794 208 2890 -2421 1798 -2728 -2007 2560 848 -799 -1818 36 45 2212 -1061 -726 983 776 -1364 -496 -1709 1585 840 -1374 -3226 -2723 -810 2285 -862 1086 -2380 -2243 -190 -2371 -539 -4922 1103 932 -2238 -2436 -4388 1237 -368 1952 -1173 -1641 756 1541 3825 2608 2511 -9 2672 341 6624 -1364 633 3803 -2116 751 1485 -666 348 2569 1651 -704 -2272 918 -4948 -2258 SS 20231213T132828.8Z 8747.561445 80 1 30.70 2 79.28 132.93 88.73 130.35 0.00 1 0.00 1 0 17 6.446e-01 1.144e-02 2.727e-01 6.407e-03 6.971826e-01 3.463157e-03 7.605906e-03 -6.000000e+00 3.669510e-01 223.00 -2.00 3.49 -2.00 321.37 0.00e+00 4.461078e-03 1.381496e-03 7.501721e-04 -6.000000e+00 1.577095e-02 278.21 -2.00 20.00 -2.00 321.04 0.00e+00 5.175 0.002 302.00 328.00 3 2.0228e+00 1.0523e-02 6.2839e-02 -6.0000e+00 9.1221e-01 1.6034e-01 1.4954e-02 3.6807e-02 -6.0000e+00 9.9821e-01 -1.7802e-01 1.7796e-02 2.1079e-02 -6.0000e+00 5.8436e-01 6.6391e-02 8.8437e-03 7.2570e-03 -6.0000e+00 2.4756e-01 1.8903e-04 -4.0966e-04 1.8762e-04 8.8491e-05 -6.0000e+00 1.8179e-02 4.7840e-03 0.0000e+00 12 9 9 12 1 1 99.98 19.37 0.37 0.00478 0.00171 37 11 1 5 0 807.800 26.21 20.01 19.37 11.17 22.7 925.92 900000 -168810 16788 -85296 -188632 -51846 -206632 900000 -141969 900000 -101775 -139736 900000 -128290 216172 -89018 62832 -64586 -27554 509404 7581 16205 -90181 900000 -77754 15406 47219 -48753 87411 -52381 13594 -8108 36828 47607 12595 44508 -10853 11008 -13394 5184 -7752 -283 10287 8575 21430 287 6468 1127 12493 14081 5887 3183 2484 8123 -1845 9136 -3323 1965 6005 350 5120 3936 7508 -133 4194 614 -997 1774 -1037 5083 1199 4628 706 1308 4500 -2858 2508 -4486 3877 -99 153 171 -1369 -542 -1493 -1959 -919 103 257 -386 1109 -1294 1168 -992 -433 -365 -480 1384 -154 179 -1056 878 -858 -697 -1433 -2142 -1391 -1980 303 -226 381 -250 738 -558 -184 450 -287 739 -405 319 -275 318 1618 209 559 -144 1281 1744 378 186 -450 90 -564 530 -262 -48 -160 370 300 -598 -93 -298 -186 900000 -1956 105 -532 -2629 -324 -3502 900000 -1658 900000 -939 -2066 900000 -2764 1349 -2044 412 -1504 -501 3180 109 215 -3203 900000 -2842 259 609 -1465 768 -1754 299 -258 911 1160 410 1076 -461 446 -807 312 -590 -22 756 661 1497 25 546 104 1092 1299 647 401 346 1168 -309 1435 -602 339 975 59 846 718 1504 -32 1049 158 -258 461 -303 1603 434 1701 268 469 1436 -884 688 -1330 1177 -37 67 85 -762 -317 -938 -1315 -640 73 183 -269 718 -804 684 -606 -292 -284 -430 1394 -173 203 -1151 856 -774 -618 -1358 -2163 -1465 -2234 365 -303 563 -396 1175 -880 -276 646 -414 1093 -636 517 -447 498 2419 308 792 -199 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