File name: Pandora179s1_CornwallCT_20241118_L2Fit_fout2c40d20221201p1-8.txt File generation date: 20241119T100236.0Z 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_20241118_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: 20241118 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 20241118T124055.3Z 9088.528418 290 1 21.37 2 82.17 124.98 67.02 287.73 0.00 1 0.00 1 0 17 5.404e-01 2.251e-02 3.387e-01 1.000e-02 7.948054e-01 5.491816e-03 8.863164e-03 -6.000000e+00 3.060948e-01 222.76 -2.00 3.52 -2.00 321.66 0.00e+00 1.121661e-02 2.790848e-03 1.599796e-03 -6.000000e+00 1.378620e-02 276.38 -2.00 20.00 -2.00 321.20 0.00e+00 6.853 0.006 302.00 328.00 3 1.7788e+00 1.8907e-02 7.8878e-02 -6.0000e+00 7.5598e-01 6.8398e-01 2.6014e-02 5.1532e-02 -6.0000e+00 8.2851e-01 -8.6531e-01 2.5772e-02 2.3442e-02 -6.0000e+00 4.9234e-01 3.5552e-01 1.2198e-02 1.4478e-02 -6.0000e+00 2.0822e-01 6.0043e-05 -1.9698e-03 2.7168e-04 1.5238e-04 -6.0000e+00 1.5014e-02 1.4923e-02 0.0000e+00 12 9 9 12 1 1 99.94 22.66 0.70 0.01492 0.00012 18 10 1 5 0 1124.260 25.90 20.00 22.66 11.25 33.0 923.25 -163804 900000 -61070 900000 -15549 -118415 -99356 -202909 22569 -9256 -188274 -145966 -142589 -92445 900000 10857 87780 122196 -55192 900000 116170 99253 108505 -53166 89381 56247 15016 -5831 20144 -64104 33845 -52178 53656 900000 30225 33697 -33127 19789 88199 287128 14518 43820 44713 40429 -14544 19896 5728 35063 37654 21064 16881 53916 11613 30120 20379 52255 22021 253 16927 21281 5269 19302 11133 18117 6963 -6584 13919 2073 3796 12087 13532 8818 12388 979 571 -1646 -6920 -10630 2750 -4299 -5957 1912 -1477 -5306 436 4987 -1535 764 1582 -7063 1586 -3686 -2991 337 -506 -2057 -2533 -107 -146 -1857 -30 -1722 -864 108 -1819 10 316 -2665 -3525 -1159 874 -925 -111 756 -670 -1136 -369 904 627 372 1601 -213 1238 2080 -37 3842 543 2368 1332 1358 300 -915 -60 -206 -190 428 173 80 -192 -278 367 -1056 -1544 -4789 900000 -812 900000 -152 -2098 -1408 -8269 220 -90 -7006 -3879 -4674 -2457 900000 164 855 1191 -2151 900000 1132 967 1057 -1931 871 698 279 -129 373 -2726 726 -2958 1360 900000 1001 1018 -1849 810 2149 2798 875 2306 2440 2364 -1353 1474 457 2392 2642 1868 1727 4256 1389 3552 2528 5296 2770 39 2309 2696 801 2803 1835 3194 1481 -1598 2738 476 938 3148 3824 2711 3600 297 156 -410 -1698 -2788 721 -1462 -2449 838 -741 -2933 241 2797 -962 480 983 -4606 885 -2038 -1601 183 -318 -1551 -2265 -108 -150 -1955 -32 -1652 -739 91 -1660 9 317 -2984 -4070 -1495 1248 -1448 -175 1156 -992 -1634 -534 1353 995 609 2534 -328 1798 2899 -51 4914 702 3202 2099 2456 609 -1873 -128 -474 -468 1095 452 211 -502 -691 841 -2287 -3245 SS 20241118T130328.0Z 9088.544074 302 1 48.39 2 78.82 129.16 70.84 290.80 0.00 1 0.00 1 0 25 2.592e-01 5.378e-03 7.584e-02 1.583e-03 6.096221e-01 8.208316e-04 6.867442e-03 -6.000000e+00 1.454509e-01 222.76 -2.00 3.52 -2.00 320.80 0.00e+00 2.190756e-03 3.400919e-04 6.591833e-04 -6.000000e+00 6.385801e-03 276.38 -2.00 20.00 -2.00 320.29 0.00e+00 4.982 0.002 302.00 328.00 3 1.1769e+00 2.5208e-03 5.6271e-02 -6.0000e+00 3.5801e-01 5.7012e-02 3.3361e-03 3.2323e-02 -6.0000e+00 3.9093e-01 -3.6287e-02 3.4488e-03 1.6677e-02 -6.0000e+00 2.3296e-01 5.0965e-03 1.7102e-03 5.9242e-03 -6.0000e+00 9.8594e-02 7.9084e-04 -7.0960e-04 4.4548e-05 6.2536e-05 -6.0000e+00 7.0604e-03 1.3149e-02 0.0000e+00 10 0 0 10 0 0 99.99 22.67 0.34 0.01315 0.00782 381 91 1 5 0 126.990 25.90 19.99 22.67 12.87 33.4 933.06 -78591 -5895 -67644 -110104 -77369 -89429 -48171 -126703 -71258 -74625 -100759 -66135 -69884 -31403 -28425 -208 -28012 -15965 -25728 -4531 -14495 -18879 6080 -16887 -4739 -7815 -12079 -17843 -10990 -23253 -6581 -10890 -203 2810 -7991 -2368 -7160 1411 -1458 3320 -3268 461 -838 709 -666 -95 -372 1553 2264 -1413 1932 1837 1626 1341 1562 2160 1107 784 144 913 -14 1294 1949 3746 852 24 1313 521 1602 1296 1374 717 996 76 -75 -570 245 -1348 304 -467 -1142 -545 -1850 -1545 -1084 -533 -632 -138 451 375 455 326 504 640 585 -220 591 800 186 -236 -19 -689 -155 117 -904 -956 -810 -797 -379 151 222 -83 92 156 -11 353 480 81 118 -369 -248 -105 263 266 322 603 310 1071 286 118 115 -357 -220 -41 -228 -118 64 263 -151 -99 151 -135 -215 -437 -19 -449 -1122 -525 -663 -253 -1662 -616 -737 -1369 -704 -960 -378 -421 -3 -575 -323 -627 -95 -349 -478 125 -477 -129 -235 -392 -600 -338 -854 -240 -496 -10 142 -440 -121 -418 89 -117 307 -368 54 -106 91 -88 -13 -51 216 326 -225 329 351 343 281 348 499 267 190 34 211 -3 337 572 1215 301 8 443 181 605 565 663 365 502 37 -33 -227 90 -506 124 -228 -655 -354 -1336 -1180 -881 -422 -526 -117 381 306 376 252 372 484 493 -198 607 935 238 -301 -22 -744 -153 116 -976 -1092 -975 -1027 -531 216 351 -138 151 247 -17 503 688 122 188 -614 -409 -167 402 391 493 884 442 1589 443 205 217 -721 -430 -86 -505 -274 153 630 -360 -226 325 -276 -429 SS 20241118T140443.9Z 9088.586619 340 1 13.74 2 70.81 141.62 80.80 299.35 0.00 1 0.00 1 0 17 6.460e-02 9.937e-03 4.492e-02 5.733e-03 3.770362e-01 2.838190e-03 4.457333e-03 -6.000000e+00 3.627879e-02 222.76 -2.00 3.52 -2.00 318.55 0.00e+00 1.547987e-03 5.872560e-04 1.303545e-04 -6.000000e+00 1.592277e-03 276.38 -2.00 20.00 -2.00 317.94 0.00e+00 3.008 0.000 302.00 328.00 3 4.6725e+00 7.6329e-03 3.3949e-02 -6.0000e+00 8.9299e-02 8.7450e-02 8.7477e-03 1.9098e-02 -6.0000e+00 9.7486e-02 -8.9845e-03 6.1406e-03 9.5668e-03 -6.0000e+00 5.8094e-02 -7.4148e-03 3.2468e-03 3.1446e-03 -6.0000e+00 2.4606e-02 1.7897e-04 -1.0700e-04 1.6516e-04 3.2745e-05 -6.0000e+00 1.7597e-03 8.1713e-03 0.0000e+00 12 9 9 12 1 1 99.99 22.68 0.08 0.00817 0.00737 5 5 1 5 0 2289.410 25.90 20.00 22.68 14.08 33.6 940.24 19540 28180 -21548 376 12807 -8284 19527 -19183 8497 1718 -35555 -8540 -21812 -1811 10382 3747 16918 -3985 180 6769 -2386 3751 4076 -7351 1562 10830 -5202 -3616 -886 -8522 -1560 842 -1982 11297 -1649 3272 -5879 -1969 1251 1930 -4102 110 183 -695 -4880 -1068 -1257 605 -489 1199 554 4373 102 1944 -339 3603 858 354 1125 1631 -198 1816 1741 2603 322 -3924 627 -1025 473 1101 1089 2467 475 -443 -2069 587 -1025 -2638 413 -2027 -1764 -892 -1745 -2174 -298 522 -110 234 450 -1112 1684 -190 -16 1166 1449 604 -20 939 296 -209 -951 -780 -314 -418 -430 -289 24 -1170 -467 321 432 -282 70 456 417 434 -528 183 -54 -78 -365 252 -292 865 267 1797 320 736 82 -84 -244 -460 -23 -446 -125 92 -282 884 -547 705 -278 -60 -715 585 889 -1188 16 440 -331 663 -996 377 88 -2684 -512 -1716 -140 842 373 1601 -493 23 833 -331 487 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