File name: Pandora51s1_OldFieldNY_20230305_L2Fit_fout2c5d20211018p1-8.txt File generation date: 20251205T035042.2Z 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 v1.8.75 Instrument operation file used: Pandora51_OF_v5d20190801.txt Instrument calibration file used: Pandora51s1_CF_v5d20211018.txt Level 1 file used: Pandora51s1_OldFieldNY_20230305_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: 20230305 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 20230305T122515.5Z 8464.517541 270 1 48.82 2 78.96 108.13 105.24 311.24 0.00 1 0.00 1 0 25 3.304e-01 5.089e-03 2.243e-01 2.801e-03 7.208673e-01 1.603723e-03 8.080417e-03 -6.000000e+00 1.978094e-01 225.72 -2.00 3.51 -2.00 321.44 0.00e+00 5.459141e-03 7.910756e-04 2.323489e-03 -6.000000e+00 8.781877e-03 276.42 -2.00 20.00 -2.00 320.98 0.00e+00 5.040 0.002 302.00 328.00 3 1.3512e+00 5.4829e-03 6.5744e-02 -6.0000e+00 4.8971e-01 6.9845e-02 8.0171e-03 4.6286e-02 -6.0000e+00 5.3071e-01 -4.0809e-02 8.9417e-03 2.2536e-02 -6.0000e+00 3.1585e-01 3.2847e-03 4.2101e-03 1.0328e-02 -6.0000e+00 1.3650e-01 4.1097e-04 -1.2003e-03 8.6525e-05 1.0844e-04 -6.0000e+00 1.0205e-02 7.3579e-03 -1.2216e-04 10 0 0 10 0 0 99.54 22.10 0.31 0.00736 -0.00166 228 52 1 5 0 214.060 26.73 20.00 22.10 7.35 15.2 905.16 900000 900000 -175090 -116808 -133508 3099 -96311 -149143 -64803 -133834 2667 -97289 -39909 -49140 -55296 438 -41695 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-622 7 49 214 863 439 738 478 534 599 876 605 -626 -508 129 260 430 -255 -1102 -1522 -231 -660 -316 -83 -228 -627 -249 1 363 1194 1438 693 -382 -576 -341 337 370 -15 -84 6 1564 1144 47 -410 -543 -207 64 -66 -746 -461 408 323 -462 -357 368 302 900000 SS 20230305T123109.5Z 8464.521638 273 1 48.64 2 77.91 109.17 106.06 312.35 0.00 1 0.00 1 0 25 4.214e-01 1.085e-02 2.419e-01 5.367e-03 6.691652e-01 3.068806e-03 7.576752e-03 -6.000000e+00 2.553394e-01 225.72 -2.00 3.51 -2.00 321.29 0.00e+00 4.689829e-03 1.439210e-03 1.544537e-03 -6.000000e+00 1.133524e-02 276.42 -2.00 20.00 -2.00 320.82 0.00e+00 4.632 0.002 302.00 328.00 3 2.4964e+00 1.0211e-02 5.9539e-02 -6.0000e+00 6.3206e-01 6.4851e-02 1.4088e-02 3.9892e-02 -6.0000e+00 6.8561e-01 -6.9627e-02 1.4774e-02 1.9981e-02 -6.0000e+00 4.0513e-01 2.5890e-02 7.0742e-03 8.5516e-03 -6.0000e+00 1.7248e-01 2.0331e-04 -1.2554e-03 1.6959e-04 9.6182e-05 -6.0000e+00 1.3294e-02 7.0479e-03 -8.7554e-05 12 9 8 11 8 0 99.96 22.11 0.22 0.00705 -0.00239 228 52 1 5 0 213.270 26.73 20.00 22.11 7.79 15.2 908.69 -154362 -61563 900000 -186562 900000 -224510 900000 -171256 -62360 5021 -131072 58201 -111136 900000 -117101 -982 -26678 28893 620 -48715 112016 -75177 35407 -55785 33572 -43104 11328 14399 -33318 58196 -44113 29744 -6896 13907 -1026 -5102 10586 -13444 24084 -2986 3449 -15416 2838 7180 -2406 9817 -3220 19961 2859 12368 8055 7492 12184 5693 4246 45 6986 -2006 1274 36 847 11340 2618 6045 -570 1402 3188 900 5516 -187 2562 -321 2605 -191 604 -188 -1071 1533 -2624 3374 -2564 -1295 -2022 -2790 -682 -1777 419 -1185 796 -839 1240 828 111 1202 -775 850 51 473 -890 -820 -135 -67 1783 -907 -592 -1779 -897 -499 -365 -157 -1040 373 -407 258 435 1079 1225 28 410 -990 185 -172 887 85 181 861 770 1966 -308 259 -342 370 -155 87 -202 -566 391 -134 -29 -315 -165 71 900000 -1308 -322 900000 -2456 900000 -4187 900000 -2409 -350 26 -1654 304 -1844 900000 -3101 -11 -409 291 9 -1121 608 -2295 423 -1619 470 -1262 200 255 -941 815 -1875 762 -266 463 -38 -208 423 -797 1223 -217 260 -1456 241 601 -221 848 -319 1699 299 1293 985 1023 1689 907 722 8 1213 -376 227 7 165 2231 618 1505 -155 372 846 261 1714 -67 960 -126 989 -69 198 -57 -320 476 -979 1396 -1267 -708 -1205 -1786 -456 -1270 305 -887 574 -585 792 505 68 779 -582 728 49 508 -1014 -910 -138 -64 1588 -852 -588 -1888 -1007 -588 -475 -227 -1643 602 -654 395 635 1530 1770 43 655 -1630 295 -265 1305 124 254 1164 1043 2831 -495 461 -664 758 -337 201 -483 -1408 983 -340 -73 -771 -381 156 900000 SS 20230305T131240.5Z 8464.550469 298 1 49.88 2 70.69 116.84 111.37 320.67 0.00 1 0.00 1 0 17 3.875e-01 9.802e-03 1.573e-01 8.315e-03 4.306712e-01 4.434336e-03 5.039418e-03 -6.000000e+00 2.321822e-01 225.72 -2.00 3.51 -2.00 319.71 0.00e+00 1.900485e-03 1.267251e-03 2.204618e-04 -6.000000e+00 1.004283e-02 276.42 -2.00 20.00 -2.00 319.16 0.00e+00 2.989 0.000 302.00 328.00 3 5.4370e+00 1.2530e-02 3.7262e-02 -6.0000e+00 5.7490e-01 1.0294e-01 1.4766e-02 2.2502e-02 -6.0000e+00 6.2274e-01 -2.2830e-02 1.2053e-02 1.1456e-02 -6.0000e+00 3.7018e-01 1.9378e-03 6.2942e-03 4.1938e-03 -6.0000e+00 1.5796e-01 6.5108e-05 6.2111e-05 2.6850e-04 4.8286e-05 -6.0000e+00 1.1938e-02 5.2462e-03 3.3403e-05 12 9 9 12 9 1 99.99 22.09 0.99 0.00525 0.00571 21 5 1 5 0 2266.530 26.73 20.00 22.09 9.18 15.1 917.47 21458 -45985 -61356 -16325 137343 -28427 -17655 -36326 407680 -29561 -34769 -16240 5831 -302 22856 51915 20848 10047 9903 26931 -5853 -3185 1307 3789 9889 -16254 18213 18234 1359 8109 3486 8186 -10724 7046 3657 -4331 1909 -1834 -267 -5185 1409 -5094 1235 -2312 -2992 2029 -3608 1643 -3604 3054 -2523 2412 -1142 -2577 3679 -273 1712 348 519 2614 -183 2726 1641 514 -2809 -49 1843 2731 1425 -37 2622 -796 2786 927 136 114 -772 -3457 -1067 1464 -1806 -124 -2317 -2159 -972 -732 917 -260 425 -330 -829 -487 464 72 -1160 1659 821 1449 -332 319 -548 60 374 -537 -174 -672 -326 -293 360 216 -204 362 -385 233 127 -342 229 -234 465 -1645 -408 536 1422 708 595 -548 189 1004 337 -625 -396 -306 79 50 -62 -275 517 279 270 -530 -36 -359 900000 343 -1482 -2251 -376 1113 -716 -437 -1178 3305 -1020 -1337 -606 209 -13 941 1828 1053 604 626 1484 -441 -238 98 296 783 -1670 1337 1289 114 679 344 838 -1428 787 413 -554 260 -308 -52 -1188 328 -1328 311 -611 -802 533 -1003 437 -1034 867 -821 808 -414 -1000 1424 -110 698 142 208 1040 -79 1254 834 271 -1513 -25 910 1385 807 -23 1700 -545 1836 585 79 60 -389 -1832 -612 935 -1344 -99 -2035 -1959 -930 -739 948 -276 440 -333 -780 -425 386 62 -1112 1741 952 1826 -439 406 -670 68 405 -611 -210 -857 -426 -407 534 346 -346 614 -637 360 184 -494 334 -352 733 -2729 -666 844 2199 1055 846 -755 255 1406 517 -1045 -684 -548 146 97 -128 -589 1125 615 588 -1117 -71 -695 900000 SS 20230305T132316.8Z 8464.557833 301 1 48.58 2 68.92 118.92 112.59 322.93 0.00 1 0.00 1 0 25 2.614e-02 5.128e-03 1.225e-02 1.115e-03 3.993291e-01 5.916407e-04 4.737555e-03 -6.000000e+00 1.565875e-02 225.72 -2.00 3.51 -2.00 319.43 0.00e+00 8.760835e-04 1.557641e-04 2.107350e-04 -6.000000e+00 6.773456e-04 276.42 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