File name: Pandora51s1_OldFieldNY_20241117_L2Fit_fout2c5d20211018p1-8.txt File generation date: 20241119T081732.7Z 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 v1.8.60 Instrument operation file used: Pandora51_OF_v5d20190801.txt Instrument calibration file used: Pandora51s1_CF_v5d20211018.txt Level 1 file used: Pandora51s1_OldFieldNY_20241117_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: 20241117 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 20241117T130221.3Z 9087.543303 304 1 6.09 2 78.14 128.83 81.91 299.10 0.00 1 0.00 1 0 25 2.564e-01 1.152e-02 2.160e-01 8.005e-03 5.382217e-01 4.344916e-03 6.315300e-03 -6.000000e+00 1.522897e-01 223.19 -2.00 3.51 -2.00 320.37 0.00e+00 4.640552e-03 1.644137e-03 1.439038e-03 -6.000000e+00 7.326435e-03 280.16 -2.00 20.00 -2.00 319.81 0.00e+00 4.713 0.002 302.00 328.00 3 2.7216e+00 1.3082e-02 5.5372e-02 -6.0000e+00 3.7531e-01 3.2731e-02 1.6449e-02 3.1662e-02 -6.0000e+00 4.0751e-01 -2.0978e-02 1.5411e-02 1.4832e-02 -6.0000e+00 2.4252e-01 4.0153e-04 7.7815e-03 7.8310e-03 -6.0000e+00 1.0504e-01 1.7929e-04 -9.1631e-04 2.5081e-04 6.8607e-05 -6.0000e+00 7.9172e-03 9.8525e-03 -9.9951e-05 12 9 9 12 1 1 99.55 22.27 0.40 0.00985 0.00297 6 13 1 5 0 868.830 26.94 19.99 22.27 13.99 21.6 949.92 -74582 900000 42266 83203 -140572 -89795 -42874 -75211 900000 -111699 900000 -87270 76111 -28496 33093 15591 -38974 28747 -94 29861 -15322 19203 -13031 -392 -15432 5188 -844 25396 13553 -10320 699 -14335 16435 20770 -11417 33732 -19611 27489 2498 4740 6820 -2649 6786 -9528 3369 -5554 2339 5788 6247 4869 -3501 2100 -957 4000 -3239 3404 2874 -2976 4173 -3807 7310 -349 2595 913 2417 1280 -1084 1676 227 2510 -2085 699 -899 -1232 -2371 -1739 2157 3928 1715 -3754 -1712 -54 -1867 936 -1730 -1070 -511 -1023 -426 394 2356 577 2190 1004 968 -153 497 -530 -502 741 -1032 829 1218 979 -319 -1765 -417 -603 439 -804 -320 -1361 471 -1169 1454 1371 1094 1082 -546 -648 -1121 6 180 -279 584 648 1713 1175 223 29 -831 210 367 438 -414 -614 -56 -306 74 205 476 -635 900000 -898 900000 330 649 -3290 -1341 -453 -1190 900000 -2880 900000 -2307 594 -661 516 334 -1512 654 -3 745 -594 556 -536 -15 -716 208 -36 843 511 -540 38 -1052 974 1196 -895 1827 -1961 2110 287 595 920 -418 1015 -1721 547 -1009 401 991 1117 953 -802 499 -254 1079 -956 969 852 -903 1195 -1174 2214 -124 997 374 1004 524 -455 723 108 1307 -1189 395 -502 -662 -1175 -804 927 1741 861 -2260 -1128 -39 -1440 748 -1484 -966 -478 -976 -397 354 1937 466 1708 818 884 -155 557 -650 -639 905 -1218 900 1271 1062 -366 -2169 -526 -804 621 -1237 -514 -2255 749 -1831 2145 1977 1615 1646 -890 -1064 -1830 9 278 -423 861 922 2404 1766 361 50 -1538 396 715 886 -881 -1336 -124 -687 163 441 987 -1304 900000 SS 20241117T130717.3Z 9087.546728 307 1 3.23 2 77.42 129.76 82.69 299.81 0.00 1 0.00 1 0 17 1.626e-01 8.461e-03 1.631e-01 6.273e-03 5.169753e-01 3.333702e-03 6.058450e-03 -6.000000e+00 9.640798e-02 223.19 -2.00 3.51 -2.00 320.00 0.00e+00 2.316416e-03 1.117945e-03 3.202232e-04 -6.000000e+00 4.278880e-03 280.16 -2.00 20.00 -2.00 319.42 0.00e+00 4.463 0.002 302.00 328.00 3 2.0582e+00 9.7048e-03 5.1761e-02 -6.0000e+00 2.3703e-01 2.5093e-02 1.1837e-02 2.7151e-02 -6.0000e+00 2.5710e-01 -9.9716e-03 1.0520e-02 1.3875e-02 -6.0000e+00 1.5348e-01 -3.5630e-03 5.4261e-03 5.0973e-03 -6.0000e+00 6.6001e-02 4.5380e-04 -7.5309e-04 1.9338e-04 5.8213e-05 -6.0000e+00 5.0062e-03 1.0111e-02 -4.4142e-05 12 9 1 12 1 1 98.46 22.28 0.19 0.01011 0.00445 7 27 1 5 0 402.610 26.94 20.00 22.28 14.17 21.6 951.16 -50109 -9427 -70561 -42721 -38189 -70014 14928 -35595 24294 -5889 7962 -45638 103102 1024 33949 31479 -8519 4208 -8936 22049 11760 -16466 2644 -9444 27087 -1984 -2651 -4790 18439 -9930 747 -2525 -6187 -3450 -8970 187 -6211 -6998 -1349 -4232 2537 -4502 3145 -6367 816 -1457 616 -2769 -1749 4416 -74 4847 571 1571 2715 1998 -74 -1408 725 232 5369 719 3119 722 139 969 829 3898 1447 1083 -302 962 -83 -1115 664 -1471 401 -628 -83 -1390 -1345 -948 -3214 -342 -1611 -305 -932 -1153 382 208 1841 -668 954 324 1754 331 578 -264 -529 -1124 855 878 687 439 -1024 -638 -494 -165 454 -379 -311 -42 272 -395 313 996 611 954 79 -476 -616 -104 -231 -153 218 130 1876 329 85 -358 -281 -23 -197 664 -879 -542 452 290 43 -810 262 296 900000 -697 -99 -1347 -604 -496 -1259 135 -585 249 -84 108 -1174 841 26 743 805 -338 164 -411 797 480 -892 126 -548 1194 -118 -157 -284 912 -682 53 -213 -576 -325 -882 18 -699 -928 -203 -753 462 -909 611 -1388 168 -313 132 -629 -411 1049 -20 1349 180 522 933 696 -27 -508 259 83 1937 301 1380 350 68 456 390 1872 775 636 -193 618 -52 -668 365 -774 199 -329 -48 -915 -987 -752 -2746 -302 -1510 -299 -938 -1181 379 201 1660 -581 817 287 1674 359 680 -332 -693 -1438 1036 998 756 503 -1244 -800 -644 -226 661 -587 -504 -69 444 -615 475 1461 918 1473 127 -780 -1019 -166 -365 -235 321 189 2655 493 136 -618 -503 -42 -374 1302 -1825 -1149 970 621 93 -1714 531 585 900000 SS 20241117T131628.6Z 9087.553109 310 1 11.88 2 76.10 131.54 84.12 301.15 0.00 1 0.00 1 0 25 8.993e-02 6.270e-03 3.369e-02 1.866e-03 4.783484e-01 9.889177e-04 5.660614e-03 -6.000000e+00 5.333691e-02 223.19 -2.00 3.51 -2.00 319.82 0.00e+00 1.278335e-03 3.102281e-04 4.643266e-04 -6.000000e+00 2.367001e-03 280.16 -2.00 20.00 -2.00 319.22 0.00e+00 4.069 0.001 302.00 328.00 3 1.3657e+00 2.8372e-03 4.7389e-02 -6.0000e+00 1.3114e-01 3.5073e-02 3.4121e-03 2.5137e-02 -6.0000e+00 1.4223e-01 -1.8236e-02 2.9005e-03 1.2580e-02 -6.0000e+00 8.4912e-02 -1.9869e-03 1.5027e-03 4.0359e-03 -6.0000e+00 3.6517e-02 1.3760e-03 -8.3879e-04 5.8744e-05 5.0579e-05 -6.0000e+00 2.7694e-03 9.9357e-03 -3.1340e-05 12 1 1 12 1 1 99.89 22.28 0.26 0.00994 0.00363 76 72 1 5 0 153.840 26.94 20.00 22.28 14.65 21.7 954.36 -29567 -21790 -20853 -51323 -6198 -52301 21246 -36736 -12373 -14601 -27194 -5216 -18340 5172 -4427 332 -1754 1161 1799 -6596 5217 -7130 6478 -4826 -154 -2882 -6131 1071 -4848 4700 -4236 2499 -1337 -2437 -441 -2412 1034 -1772 501 -1537 -1329 -2224 -1446 -817 -636 1429 -566 1041 -357 1791 1702 232 2131 -195 1296 -511 904 -137 651 1388 1548 2610 851 1214 -332 1004 910 1217 1636 107 556 -317 -153 -602 -278 -304 -111 891 -674 -132 -1168 -1525 -1726 -985 -861 -806 51 -444 -16 -105 555 828 1091 1376 295 812 272 314 -720 -556 -79 470 1035 -96 -905 -1175 -527 -343 130 -14 -379 -148 -225 333 632 1237 791 220 -265 -832 -564 -334 196 66 226 483 1276 1396 11 -47 -469 -178 345 -65 -290 -245 160 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