File name: Pandora51s1_OldFieldNY_20220831_L2Fit_fout2c5d20211018p1-8.txt File generation date: 20251205T030904.4Z 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_20220831_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: 20220831 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 20220831T115559.0Z 8278.497211 89 1 7.47 2 72.53 93.85 119.38 76.27 0.00 1 0.00 1 0 25 1.456e-01 1.349e-02 2.053e-01 1.308e-02 4.730240e-01 6.938198e-03 5.462450e-03 -6.000000e+00 8.728838e-02 230.52 -2.00 3.51 -2.00 319.79 0.00e+00 -2.036479e-04 2.140138e-03 8.009598e-04 -6.000000e+00 3.952818e-03 289.08 -2.00 20.00 -2.00 318.98 0.00e+00 3.282 0.001 302.00 328.00 3 4.8756e+00 2.0294e-02 4.1404e-02 -6.0000e+00 2.1753e-01 8.5284e-02 2.4255e-02 2.5341e-02 -6.0000e+00 2.3567e-01 -7.7482e-02 1.8337e-02 1.2018e-02 -6.0000e+00 1.4069e-01 2.1752e-02 9.3515e-03 3.2856e-03 -6.0000e+00 5.8551e-02 8.4811e-05 -9.4793e-04 4.1211e-04 4.1487e-05 -6.0000e+00 4.4834e-03 -3.1171e-03 1.1578e-05 12 9 9 12 1 1 999.00 22.22 0.63 -0.00312 -0.01024 2 5 1 5 0 2428.130 26.83 20.00 22.22 26.71 14.2 1015.44 6973 17921 16553 -81570 31512 -25885 -71035 -20661 -65903 -13277 14142 -45273 -46984 34059 15112 -7475 -7085 25589 9155 -27931 -19793 -3592 -6994 4032 -16528 20449 9297 5207 10170 -6507 4535 8641 -13127 5045 -5315 -503 6164 -4603 2557 -253 -2510 -6953 -2224 225 -3557 8080 2237 -1694 11760 -3543 613 2685 1901 2256 2148 7319 1966 4825 -166 910 3754 7460 2616 -770 1049 3318 -1934 1671 623 -100 1232 238 -498 -2307 -2492 -491 398 848 -483 1272 -1640 -4703 -2227 -835 -61 270 1671 -52 -525 -246 -2624 723 426 -4751 -78 690 564 976 447 -330 -987 -1810 1189 -570 -570 -199 402 -684 -1389 408 1179 132 409 -398 916 986 1646 -123 -812 -999 9 -45 1339 833 35 1298 119 2140 -198 316 -643 -1238 -8 933 -842 -292 -609 899 888 -568 -760 144 -387 106 267 259 -2958 402 -550 -2548 -520 -2795 -362 311 -1983 -2429 990 604 -409 -419 1200 534 -2382 -1582 -250 -533 296 -1587 1439 721 404 743 -583 410 841 -1683 561 -641 -60 780 -754 468 -55 -592 -1807 -568 57 -936 1951 574 -445 2847 -1033 187 872 670 843 839 2802 785 1899 -67 368 1551 3246 1280 -414 553 1644 -992 857 356 -63 822 165 -340 -1511 -1496 -269 204 441 -282 816 -1229 -3935 -1909 -750 -58 266 1693 -54 -546 -248 -2522 642 365 -4418 -74 720 652 1211 581 -422 -1211 -2111 1293 -653 -680 -250 518 -949 -2052 629 1879 216 665 -618 1347 1401 2354 -188 -1290 -1646 14 -72 2071 1242 52 1805 164 3033 -306 519 -1115 -2216 -14 1762 -1681 -604 -1273 1873 1867 -1168 -1522 280 -750 SS 20220831T120042.2Z 8278.500488 92 1 10.56 2 71.64 94.65 118.56 77.14 0.00 1 0.00 1 0 17 1.547e-01 1.191e-02 1.322e-01 7.846e-03 4.344179e-01 4.150608e-03 5.156345e-03 -6.000000e+00 9.270026e-02 230.52 -2.00 3.51 -2.00 319.84 0.00e+00 -1.348724e-04 1.293390e-03 1.693828e-03 -6.000000e+00 4.198623e-03 289.08 -2.00 20.00 -2.00 319.03 0.00e+00 3.133 0.001 302.00 328.00 3 4.5312e+00 1.2204e-02 3.9684e-02 -6.0000e+00 2.3102e-01 -8.6439e-03 1.4587e-02 2.5611e-02 -6.0000e+00 2.5030e-01 -7.4229e-03 1.1029e-02 1.1306e-02 -6.0000e+00 1.4942e-01 -7.1571e-04 5.6255e-03 3.2905e-03 -6.0000e+00 6.2167e-02 1.4984e-04 -8.5181e-04 2.5322e-04 3.8725e-05 -6.0000e+00 4.7628e-03 -1.4658e-03 -7.8381e-06 12 9 9 12 1 1 100.00 22.22 0.18 -0.00147 -0.00787 11 13 1 5 0 864.590 26.83 20.00 22.22 26.84 14.1 1016.21 60760 2249 -17657 -6049 -69830 23028 -51063 615 -53860 -29492 83484 -49773 44168 -23230 2016 -12364 2081 21925 -27497 7756 -20454 16138 -21764 15772 -8315 -3942 174 7863 25528 -7550 12534 -8563 1553 4915 -12336 11113 -6362 10908 -1677 4492 -3535 -784 3609 -2463 4354 -326 7273 -1032 -160 -423 3102 1930 -599 5225 2293 473 -683 772 3492 -2696 5183 3339 4148 -1170 642 -2344 711 2603 292 2443 -1584 4020 -1074 -1402 -761 -3153 1305 -1618 1266 -2248 607 -2556 -1760 -668 -592 -301 -2136 722 -296 1659 -1399 -1638 -768 -279 1632 -148 1846 719 -377 -849 -790 -232 -1446 64 -2299 -233 -880 -117 231 176 1855 517 700 -187 1333 461 65 -215 29 332 -280 108 875 503 -189 4 1106 476 610 -761 417 -1423 -948 -408 -847 165 -360 1278 -8 441 -15 -965 435 620 42 -398 -118 -2311 337 -1595 14 -2104 -982 1065 -2355 1053 -1193 94 -723 114 1082 -2230 472 -1639 968 -1923 1058 -736 -345 15 596 1645 -701 1065 -980 174 539 -1574 1171 -907 1563 -319 901 -839 -191 867 -637 1059 -83 1728 -268 -42 -118 911 623 -208 1824 860 186 -276 305 1357 -1099 2056 1474 1989 -612 335 -1208 348 1294 164 1467 -1065 2626 -724 -897 -454 -1751 670 -848 711 -1462 434 -2041 -1496 -597 -555 -298 -2253 754 -308 1612 -1332 -1455 -664 -241 1516 -154 2076 899 -486 -1093 -950 -263 -1598 72 -2777 -291 -1168 -160 340 275 3007 844 1130 -288 1935 653 93 -326 46 538 -457 172 1366 755 -273 6 1519 685 934 -1254 723 -2566 -1770 -782 -1695 341 -765 2714 -17 904 -30 -1884 848 SS 20220831T120458.2Z 8278.503451 95 1 20.94 2 70.84 95.37 117.81 77.92 0.00 1 0.00 1 0 25 3.539e-02 5.444e-03 2.108e-02 1.708e-03 4.145515e-01 8.999929e-04 4.783153e-03 -6.000000e+00 2.121327e-02 230.52 -2.00 3.51 -2.00 319.46 0.00e+00 7.818802e-04 2.523536e-04 1.736251e-04 -6.000000e+00 9.605761e-04 289.08 -2.00 20.00 -2.00 318.64 0.00e+00 3.010 0.000 302.00 328.00 3 2.7281e+00 2.5805e-03 3.7213e-02 -6.0000e+00 5.2866e-02 -1.3384e-02 3.0426e-03 2.1806e-02 -6.0000e+00 5.7271e-02 2.3730e-03 2.2469e-03 1.0585e-02 -6.0000e+00 3.4189e-02 -9.1926e-03 1.1580e-03 3.0432e-03 -6.0000e+00 1.4230e-02 1.0497e-03 -3.5815e-04 5.4615e-05 3.6142e-05 -6.0000e+00 1.0895e-03 -3.2387e-03 3.3386e-05 12 1 1 12 1 1 99.92 22.21 0.24 -0.00324 -0.00593 70 37 1 5 0 292.390 26.83 19.99 22.21 26.96 14.1 1016.96 -3535 -4404 -19845 -47 -23877 -966 -7760 -7273 -6703 -16094 -523 -9251 3272 -675 976 -5005 -2845 -1564 -2307 841 -2010 3067 -2709 -1131 -831 -1841 -1008 -3946 -457 456 4188 -980 -272 -2315 -5015 -402 -1501 509 -1116 -1153 -1879 -384 -686 -934 478 -316 -884 -671 72 1277 1187 1500 1084 1141 164 847 -1 121 209 632 1701 1513 1580 490 -300 203 1342 1141 1277 798 -299 33 -213 -154 167 -484 200 59 267 -669 -767 -1495 -1456 -1259 -512 -405 -432 289 64 234 604 537 846 925 1119 481 765 49 -636 -577 -373 115 247 183 -1126 -1024 -762 -550 -203 146 -31 -296 -45 104 486 688 860 542 -258 -570 -879 -37 358 444 465 336 934 1075 421 -71 -255 -96 168 170 -142 -394 107 -3 -273 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