File name: Pandora51s1_OldFieldNY_20231223_L2Fit_fout2c5d20211018p1-8.txt File generation date: 20240123T144736.6Z 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_20231223_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: 20231223 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 20231223T133332.1Z 8757.564955 215 1 48.18 2 79.09 134.72 119.90 355.27 0.00 1 0.00 1 0 33 4.720e-01 2.097e-02 3.423e-01 1.340e-02 7.162246e-01 7.436201e-03 7.941666e-03 -6.000000e+00 2.769827e-01 223.02 -2.00 3.51 -2.00 321.56 0.00e+00 -4.236296e-03 3.717071e-03 4.689206e-03 -6.000000e+00 1.262461e-02 276.69 -2.00 20.00 -2.00 321.05 0.00e+00 5.093 0.002 302.00 328.00 3 3.8502e+00 2.5474e-02 6.9785e-02 -6.0000e+00 6.8061e-01 2.6116e-01 3.4979e-02 5.7404e-02 -6.0000e+00 7.4388e-01 -3.8884e-01 3.3980e-02 2.2298e-02 -6.0000e+00 4.4181e-01 1.6214e-01 1.5952e-02 8.1285e-03 -6.0000e+00 1.8638e-01 3.3500e-05 -1.0753e-03 4.1286e-04 8.9503e-05 -6.0000e+00 1.4608e-02 2.1397e-04 -2.6739e-05 12 9 8 11 8 0 99.41 22.78 0.25 0.00021 -0.00787 22 5 1 5 0 2189.390 27.35 20.00 22.78 3.63 17.9 879.93 900000 900000 -160319 -198265 -71795 900000 13494 7252 -207989 -130569 -191455 -154486 -82304 -63737 4636 -48114 2912 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4358 1222 3233 2115 1530 3596 810 2232 1417 912 1310 2924 2949 -451 -246 -844 898 -1340 -1661 -692 -1840 1476 -342 -1256 -3024 -652 -1061 312 680 -49 501 -2400 1094 -1115 287 540 -2405 -1116 -3578 -526 -2018 -2816 -2197 -1465 -3683 -1750 -1909 917 -1075 600 866 394 2310 3005 -1572 395 -597 1290 -245 988 595 2137 2117 2380 443 1098 3744 159 2628 702 -826 1424 -640 -1736 2 -837 1216 -638 -1344 -1945 1878 -2454 SS 20231223T133855.7Z 8757.568700 218 1 49.38 2 78.37 135.74 119.95 356.67 0.00 1 0.00 1 0 25 4.763e-01 1.315e-02 3.161e-01 9.924e-03 6.699632e-01 5.480401e-03 7.565594e-03 -6.000000e+00 2.777514e-01 223.02 -2.00 3.51 -2.00 321.43 0.00e+00 8.978583e-03 2.707240e-03 8.783503e-04 -6.000000e+00 1.288845e-02 276.69 -2.00 20.00 -2.00 320.92 0.00e+00 4.804 0.002 302.00 328.00 3 3.7916e+00 1.8526e-02 5.9392e-02 -6.0000e+00 6.8267e-01 1.6640e-01 2.5155e-02 3.6478e-02 -6.0000e+00 7.4561e-01 -2.1950e-01 2.5642e-02 1.9912e-02 -6.0000e+00 4.4467e-01 9.3862e-02 1.2194e-02 1.0232e-02 -6.0000e+00 1.8637e-01 4.7185e-05 -1.6888e-03 3.0929e-04 1.3487e-04 -6.0000e+00 1.4713e-02 -4.0879e-04 -1.6049e-05 12 9 9 12 8 8 98.75 22.78 0.24 -0.00041 -0.01310 23 5 1 5 0 2146.500 27.35 19.99 22.78 3.95 17.9 881.92 -190593 -195305 900000 -3400 -206465 -141066 -190239 -73583 182071 96221 -51021 900000 -103258 -71808 -19305 -67225 -26038 -52622 18173 57435 -47842 -78308 161619 900000 -9827 25657 -40618 -25984 -56593 5313 -28356 -15543 23785 -4579 4289 42116 -598 22761 21624 -897 7026 21745 -12445 35376 9534 10530 -6882 18504 20407 9544 29398 800 13774 8221 -7450 10858 528 1461 -1133 8284 12129 2390 6589 7522 5836 6380 9805 -4619 3467 2829 -2184 1090 -235 148 -3349 -5609 -4257 1058 -571 288 -118 1212 -617 -123 -2796 -2135 321 -558 -1858 -3111 1546 2265 -872 -772 1474 1622 -4 -64 16 93 -407 -2183 -368 -1997 -826 -1214 -76 -1052 244 663 -610 183 -652 1162 987 503 346 -45 -330 -53 -338 642 181 -224 1410 1426 1602 836 -158 -623 -17 -38 651 -510 465 -848 -268 177 -286 344 -182 186 -332 -3189 -3778 900000 -33 -4152 -1554 -3531 -712 1761 931 -494 900000 -1803 -1196 -245 -1547 -462 -1307 251 572 -1263 -2751 1563 900000 -209 404 -1179 -670 -2042 123 -1082 -618 715 -188 158 1132 -26 958 1068 -62 497 1418 -1171 2242 785 888 -699 1570 1807 1027 2887 113 1859 1257 -1357 1733 94 254 -199 1338 2015 491 1472 1783 1450 1564 2409 -1353 1045 963 -839 413 -87 51 -1089 -1750 -1273 318 -201 115 -55 627 -352 -74 -1850 -1483 226 -403 -1342 -2170 963 1329 -523 -493 1043 1332 -4 -68 18 102 -425 -2108 -329 -1848 -801 -1249 -82 -1248 309 930 -944 292 -1044 1757 1425 711 499 -69 -526 -85 -539 978 266 -326 1946 1907 2132 1201 -250 -1109 -33 -78 1400 -1150 1100 -2113 -677 449 -717 817 -419 404 -717 SS 20231223T134353.2Z 8757.572144 221 1 48.24 2 77.73 136.70 119.97 357.96 0.00 1 0.00 1 0 17 5.151e-01 1.216e-02 2.675e-01 6.811e-03 6.513102e-01 3.719713e-03 7.309934e-03 -6.000000e+00 3.016166e-01 223.02 -2.00 3.51 -2.00 321.27 0.00e+00 6.683906e-03 1.761469e-03 1.023244e-03 -6.000000e+00 1.394271e-02 276.69 -2.00 20.00 -2.00 320.76 0.00e+00 4.569 0.002 302.00 328.00 3 3.4858e+00 1.2247e-02 5.6656e-02 -6.0000e+00 7.4459e-01 1.3742e-01 1.6554e-02 3.4556e-02 -6.0000e+00 8.1392e-01 -1.4336e-01 1.6984e-02 1.9444e-02 -6.0000e+00 4.8197e-01 5.0990e-02 8.1526e-03 9.3550e-03 -6.0000e+00 2.0080e-01 8.1554e-05 -8.7667e-04 2.1195e-04 1.2153e-04 -6.0000e+00 1.6001e-02 -4.7167e-04 9.5648e-06 12 8 8 10 0 0 88.01 22.78 0.30 -0.00047 -0.00706 35 8 1 5 0 1377.970 27.35 20.00 22.78 4.24 17.9 883.99 61377 -92287 123898 -189755 -127186 -184761 -73989 900000 -157825 900000 -137058 160082 -57979 -51982 -53357 -50196 -25771 -75533 37495 -26371 353284 -37550 3428 -13141 -15233 66944 -13650 4036 -33030 45942 49179 -71151 17490 8973 21029 -12112 35988 21148 -4099 18821 4617 -6944 -6334 277 122 20880 7496 6832 5007 5303 15618 -2018 16070 3366 5272 1719 -4783 7117 -5398 8377 992 2808 9674 10493 1875 1730 875 -396 5390 -1627 1573 2586 95 -146 -1057 700 -3781 4132 -1367 -265 -1533 -3132 -1199 -677 305 -2418 -804 -790 160 1140 -3 1973 -365 56 249 -597 1187 602 -939 -1010 -215 -455 997 -839 -1311 -1334 -1878 -359 -665 846 -864 -279 101 86 877 591 2531 -534 -49 -347 393 215 301 1205 -546 256 416 889 750 136 -272 266 476 -492 148 -617 -42 -236 -388 30 -523 810 -25 408 -677 823 -3465 -1245 -3177 -491 900000 -2687 900000 -2240 1063 -699 -763 -963 -1034 -482 -2432 451 -593 2346 -972 63 -305 -371 803 -348 86 -1046 800 997 -4983 607 348 713 -581 1238 979 -285 1204 375 -661 -628 26 12 1758 747 717 555 639 1889 -322 2332 581 957 325 -974 1298 -1097 1500 204 621 2256 2651 529 484 250 -121 1738 -631 634 1051 38 -55 -365 223 -1221 1306 -511 -115 -780 -1816 -737 -440 205 -1761 -599 -598 118 811 -2 1232 -231 38 189 -516 1160 661 -1100 -1158 -226 -437 915 -803 -1305 -1403 -2115 -431 -884 1203 -1355 -451 160 132 1294 854 3649 -830 -78 -563 621 337 453 1728 -766 344 558 1271 1203 239 -519 537 1011 -1095 347 -1517 -106 -593 -962 71 -1167 1736 -54 SS 20231223T140337.6Z 8757.585852 231 1 48.89 2 75.26 140.61 119.88 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