File name: Pandora51s1_OldFieldNY_20240911_L2Fit_fout2c5d20211018p1-8.txt File generation date: 20240912T045740.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 51 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora51_OF_v5d20190801.txt Instrument calibration file used: Pandora51s1_CF_v5d20211018.txt Level 1 file used: Pandora51s1_OldFieldNY_20240911_L1_smca1c5d20211018p1-8.txt Full location name: Flax Pond NYSDEC (USEPA AQS ID 36-103-0044) Short location name: OldFieldNY Country of location: USA Location latitude [deg]: 40.9635 Location longitude [deg]: -73.1402 Location altitude [m]: 3 Local noon date: 20240911 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: Modification of session 3 - Full Lab Cal on 1.8 for HCHO First and last pixel inside fitting window: 257 399 Nominal wavelengths inside fitting window [nm]: 305.1342 305.2748 305.4155 305.5562 305.6968 305.8375 305.9781 306.1187 306.2593 306.3999 306.5405 306.6810 306.8216 306.9621 307.1027 307.2432 307.3837 307.5242 307.6647 307.8052 307.9457 308.0861 308.2266 308.3670 308.5074 308.6478 308.7882 308.9286 309.0690 309.2094 309.3497 309.4901 309.6304 309.7707 309.9110 310.0513 310.1916 310.3319 310.4722 310.6124 310.7527 310.8929 311.0331 311.1733 311.3135 311.4537 311.5939 311.7340 311.8742 312.0143 312.1545 312.2946 312.4347 312.5748 312.7149 312.8549 312.9950 313.1350 313.2751 313.4151 313.5551 313.6951 313.8351 313.9751 314.1151 314.2550 314.3950 314.5349 314.6748 314.8147 314.9546 315.0945 315.2344 315.3743 315.5141 315.6540 315.7938 315.9336 316.0734 316.2132 316.3530 316.4928 316.6326 316.7723 316.9120 317.0518 317.1915 317.3312 317.4709 317.6106 317.7503 317.8899 318.0296 318.1692 318.3088 318.4484 318.5880 318.7276 318.8672 319.0068 319.1463 319.2859 319.4254 319.5649 319.7044 319.8439 319.9834 320.1229 320.2624 320.4018 320.5413 320.6807 320.8201 320.9595 321.0989 321.2383 321.3777 321.5170 321.6564 321.7957 321.9351 322.0744 322.2137 322.3530 322.4922 322.6315 322.7708 322.9100 323.0492 323.1885 323.3277 323.4669 323.6061 323.7452 323.8844 324.0235 324.1627 324.3018 324.4409 324.5800 324.7191 324.8582 324.9973 --------------------------------------------------------------------------------------- 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 20240911T114134.0Z 9020.487199 70 1 5.84 2 77.31 95.44 164.06 42.40 0.00 1 0.00 1 0 25 5.280e-01 2.694e-02 3.438e-01 2.012e-02 5.892114e-01 1.154035e-02 8.083182e-03 -6.000000e+00 3.311868e-01 229.51 -2.00 3.51 -2.00 320.64 0.00e+00 1.084796e-02 4.805765e-03 5.679006e-03 -6.000000e+00 1.632161e-02 288.17 -2.00 20.00 -2.00 319.99 0.00e+00 4.425 0.002 302.00 328.00 3 4.0236e+00 3.6534e-02 5.8061e-02 -6.0000e+00 8.2807e-01 1.4622e-01 4.6558e-02 4.0776e-02 -6.0000e+00 8.9787e-01 -1.7842e-01 4.0995e-02 2.4913e-02 -6.0000e+00 5.2653e-01 7.1767e-02 2.0265e-02 9.7052e-03 -6.0000e+00 2.2537e-01 5.6193e-05 -2.4332e-04 6.2873e-04 1.7759e-04 -6.0000e+00 1.7161e-02 1.0023e-02 2.7017e-05 12 9 9 12 1 1 999.00 22.12 0.45 0.01002 0.00819 1 4 1 5 0 2916.540 26.83 20.00 22.12 20.88 21.7 993.83 900000 -153002 900000 900000 -28961 900000 900000 900000 -73552 900000 -173312 59968 -85509 -115871 900000 3476 900000 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2024 1930 2239 1960 32 4976 -899 3044 -2461 6071 2856 205 570 1038 1251 -195 3868 -1 -4091 1709 59 -3790 -129 -927 -2136 -988 -2321 -2803 -1381 879 183 -1619 -717 615 1630 -5564 898 1918 450 596 267 4017 1075 -5789 -3296 -3454 -1015 -5967 2012 -1640 -926 2264 1146 719 -1168 4537 -2071 -721 1682 2112 -2789 -533 2877 1567 3133 -677 187 1255 2105 2237 380 -139 176 -1088 2793 -3116 455 -1100 -1682 2120 -1430 2026 263 -1896 -1748 900000 SS 20240911T114650.9Z 9020.490866 73 1 48.72 2 76.32 96.33 163.41 45.57 0.00 1 0.00 1 0 25 2.424e-01 6.564e-03 2.085e-01 4.281e-03 5.610955e-01 2.403079e-03 6.483493e-03 -6.000000e+00 1.477848e-01 229.51 -2.00 3.51 -2.00 320.82 0.00e+00 1.995636e-03 1.049508e-03 7.871559e-04 -6.000000e+00 6.708238e-03 288.17 -2.00 20.00 -2.00 320.17 0.00e+00 4.126 0.001 302.00 328.00 3 3.2148e+00 7.8586e-03 5.1312e-02 -6.0000e+00 3.6729e-01 -5.5978e-03 1.0294e-02 3.1324e-02 -6.0000e+00 3.9615e-01 3.0699e-02 9.5325e-03 1.5457e-02 -6.0000e+00 2.3610e-01 -2.5586e-02 4.6562e-03 5.8876e-03 -6.0000e+00 1.0081e-01 1.8250e-04 -7.2626e-04 1.3643e-04 6.4055e-05 -6.0000e+00 7.4866e-03 1.1436e-02 -7.2543e-05 11 8 0 10 0 0 99.57 22.12 0.21 0.01144 0.00598 70 16 1 5 0 695.870 26.83 20.00 22.12 21.00 21.6 994.52 -69820 -95038 19722 -52018 900000 -70133 6205 -8769 -113860 170234 -97985 22450 -20366 15663 5027 -25541 -20076 -8329 9167 -378 21954 -18089 9775 -11664 -20169 14949 -16509 -10484 -1904 -4192 327 -9808 -5943 -12516 -1953 -3534 11541 -5283 719 1947 -7603 1283 678 6429 992 4818 1872 -2828 2097 -1102 1187 -1503 2773 1397 1289 29 555 3330 -1224 2091 1755 1556 1503 762 1529 -806 2082 1369 1244 30 -131 -26 -851 142 -431 983 646 1630 -353 -503 -270 -1586 -1046 -1965 -592 -1020 -130 -772 17 642 1076 167 763 1287 406 916 1200 393 -17 -650 121 -805 1179 -34 -1199 -1295 -866 -527 -178 167 36 -120 -451 188 695 595 995 -195 -258 -888 -498 408 346 439 108 447 853 925 177 -273 -469 79 759 -392 49 -484 78 104 -474 80 -19 185 900000 -512 -968 82 -349 900000 -577 28 -51 -1942 710 -1694 152 -250 172 72 -557 -462 -187 185 -9 431 -520 235 -368 -741 414 -607 -357 -62 -156 14 -506 -324 -743 -104 -202 656 -418 65 195 -920 151 84 766 127 607 248 -407 302 -178 208 -298 572 306 296 7 135 801 -304 511 460 443 476 261 523 -276 695 488 497 13 -64 -13 -413 64 -178 376 240 629 -154 -255 -156 -1035 -731 -1441 -458 -839 -111 -669 14 524 816 120 538 955 340 854 1269 463 -21 -779 134 -824 1169 -35 -1312 -1498 -1059 -690 -248 254 59 -201 -738 290 1013 869 1478 -300 -419 -1485 -820 646 543 659 157 621 1178 1360 291 -482 -891 158 1538 -853 112 -1136 185 250 -1130 185 -41 393 900000 SS 20240911T115654.9Z 9020.497858 76 1 47.86 2 74.43 98.04 162.07 51.03 0.00 1 0.00 1 0 25 2.923e-01 1.361e-02 2.520e-01 9.030e-03 4.985897e-01 4.992453e-03 5.778813e-03 -6.000000e+00 1.787937e-01 229.51 -2.00 3.51 -2.00 320.51 0.00e+00 2.911003e-04 1.926564e-03 5.961749e-04 -6.000000e+00 8.014205e-03 288.17 -2.00 20.00 -2.00 319.81 0.00e+00 3.658 0.001 302.00 328.00 3 4.9258e+00 1.5619e-02 4.5205e-02 -6.0000e+00 4.4463e-01 1.9055e-02 1.9678e-02 2.6763e-02 -6.0000e+00 4.7962e-01 -2.0650e-02 1.6940e-02 1.3425e-02 -6.0000e+00 2.8543e-01 -1.1319e-03 8.4386e-03 3.8489e-03 -6.0000e+00 1.2164e-01 5.5575e-05 -2.3483e-04 2.9300e-04 5.1750e-05 -6.0000e+00 9.0676e-03 1.1296e-02 -1.6701e-05 12 8 8 10 0 0 99.83 22.13 0.40 0.01130 0.00953 20 5 1 5 0 2392.460 26.83 19.99 22.13 21.23 21.6 995.82 52784 12470 -54406 -25079 -172523 900000 -77686 32289 -87200 172102 85902 -29834 11946 -62164 -7381 -7366 52365 1899 103207 10278 23179 34455 17717 33872 -14092 13936 8948 -20609 3430 -4159 34326 21127 16466 -9369 18183 26625 -2447 14847 -13 1729 -8348 -6678 -2860 2286 1714 302 11206 251 3852 1519 2720 -344 -3954 8660 -1688 4433 -6274 6118 2955 639 1424 2775 3754 -2316 3944 -2173 1400 1008 2938 3900 -1953 -532 -376 -2139 -1267 -2043 2569 -1060 2173 310 -739 -5081 312 -769 -1014 -13 -957 2435 -398 769 332 117 1370 -256 2393 50 1597 288 -627 -1980 -1359 2059 -267 -171 -3002 -182 -1793 60 -92 -1159 378 -40 663 -765 2075 -514 804 25 671 -880 -1119 1951 253 842 1096 9 -72 799 934 -658 823 -1162 292 633 -847 295 -504 574 -561 193 -226 -177 900000 465 110 -812 -271 -6872 900000 -1516 284 -2283 1515 756 -620 199 -2491 -207 -233 1024 63 1428 355 717 984 641 1128 -767 607 404 -1213 160 -229 1511 1170 1037 -751 1120 1597 -220 1350 -2 241 -1404 -1165 -496 382 291 53 1766 45 693 300 582 -83 -1069 2199 -497 1268 -1973 1723 847 190 447 946 1396 -947 1545 -875 542 411 1311 1877 -1066 -292 -201 -1118 -599 -890 1023 -455 1014 170 -465 -3603 225 -597 -845 -12 -878 2190 -361 655 271 90 1012 -202 2037 48 1716 345 -781 -2426 -1538 2131 -274 -183 -3434 -214 -2265 79 -133 -1838 611 -66 1081 -1197 2982 -739 1164 38 1079 -1477 -1868 3074 392 1243 1584 13 -101 1173 1465 -1144 1505 -2269 573 1311 -1886 674 -1189 1356 -1320 434 -486 -375 900000 SS 20240911T121138.7Z 9020.508087 83 1 49.66 2 71.69 100.60 159.93 57.82 0.00 1 0.00 1 0 17 1.989e-01 9.494e-03 2.040e-01 8.462e-03 4.484668e-01 4.618294e-03 5.264974e-03 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