File name: Pandora51s1_OldFieldNY_20230820_L2Fit_fout2c5d20211018p1-8.txt File generation date: 20230821T072143.9Z 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 v1.8.49 Instrument operation file used: Pandora51_OF_v5d20190801.txt Instrument calibration file used: Pandora51s1_CF_v5d20211018.txt Level 1 file used: Pandora51s1_OldFieldNY_20230820_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: 20230820 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 20230820T111422.7Z 8632.468318 71 1 48.57 2 78.46 83.46 120.47 66.16 0.00 1 0.00 1 0 25 4.620e-01 1.681e-02 3.881e-01 1.533e-02 6.034853e-01 8.854738e-03 7.262814e-03 -6.000000e+00 2.852347e-01 231.44 -2.00 3.51 -2.00 321.19 0.00e+00 1.174957e-02 4.245099e-03 1.902142e-03 -6.000000e+00 1.294894e-02 289.92 -2.00 20.00 -2.00 320.55 0.00e+00 4.831 0.002 302.00 328.00 3 4.1604e+00 3.0733e-02 5.8264e-02 -6.0000e+00 7.1470e-01 1.9350e-01 4.0314e-02 3.2993e-02 -6.0000e+00 7.7105e-01 -2.0591e-01 3.5634e-02 2.2132e-02 -6.0000e+00 4.5960e-01 7.7055e-02 1.7142e-02 1.3857e-02 -6.0000e+00 1.9553e-01 3.2324e-05 -1.6246e-03 4.8778e-04 1.8618e-04 -6.0000e+00 1.4275e-02 3.8468e-03 -1.4812e-05 12 8 8 10 0 0 99.83 22.05 0.41 0.00385 -0.00836 23 5 1 5 0 2110.990 26.73 19.99 22.05 23.08 17.9 1005.74 -156381 900000 96023 -179986 -120307 -160839 -166639 -55617 -49859 -39824 -167150 201610 8050 -32710 -2080 -617 900000 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1506 439 1600 490 -482 1211 -866 -2088 -425 863 -2086 -2026 -1577 916 -1398 605 -1884 -446 -1673 -273 -271 -953 -365 1418 1066 1399 -2256 706 -244 109 4528 -350 -1584 -1229 772 -1136 -102 -615 -1441 -4105 -702 1095 615 -802 785 -1227 -1380 2409 -1064 -904 2746 336 -1039 1151 -355 281 1822 817 1648 1286 2490 2424 -2189 -2325 -1099 1371 119 870 499 -2009 1519 1366 -1459 -1105 -930 -42 900000 SS 20230820T111940.8Z 8632.472000 74 1 48.53 2 77.46 84.31 119.60 67.23 0.00 1 0.00 1 0 17 4.636e-01 1.347e-02 2.744e-01 9.792e-03 5.575122e-01 5.453240e-03 6.530966e-03 -6.000000e+00 2.819076e-01 231.44 -2.00 3.51 -2.00 321.07 0.00e+00 3.933185e-03 2.581820e-03 3.144179e-03 -6.000000e+00 1.303833e-02 289.92 -2.00 20.00 -2.00 320.36 0.00e+00 4.476 0.002 302.00 328.00 3 3.9891e+00 1.8923e-02 5.5311e-02 -6.0000e+00 7.0494e-01 5.7240e-02 2.4523e-02 3.4255e-02 -6.0000e+00 7.6461e-01 -5.9319e-02 2.1433e-02 1.6890e-02 -6.0000e+00 4.5473e-01 1.6163e-02 1.0321e-02 4.6139e-03 -6.0000e+00 1.9007e-01 6.0811e-05 1.4134e-04 3.2017e-04 9.0132e-05 -6.0000e+00 1.4597e-02 2.7235e-03 7.7785e-05 12 9 8 11 8 0 99.95 22.05 0.56 0.00272 0.00379 37 8 1 5 0 1311.300 26.73 20.00 22.05 23.25 17.9 1007.29 900000 900000 -170372 -161295 47073 -151397 900000 -180495 11008 -90365 -87869 320465 900000 18654 -78198 900000 -56433 54043 3859 91949 7185 -2445 56246 -7164 122319 18361 43926 10376 8808 10195 40294 -27683 -8124 16256 -14354 18713 54338 -14765 1592 4044 17017 24 2834 7086 -2524 13987 -11772 8959 -3242 10566 11972 4250 7545 6798 10889 -3851 4692 -3427 9469 5814 -880 9496 3191 4768 -5269 2868 -1827 7415 1662 1606 -224 -3087 638 -1795 1762 -2154 2990 -682 1029 2158 3428 -2040 -1093 -1044 -1293 -1012 -1696 -44 -504 -2604 1735 -1283 334 -341 -701 -445 -644 818 -1304 593 -1184 -999 -661 717 -66 -1828 -1608 -523 98 735 1310 742 -10 517 -362 911 265 525 36 -308 -313 -188 1621 -738 804 -108 1072 1497 246 11 -910 85 78 -170 -588 -503 253 -437 624 482 164 -137 -687 900000 900000 -4172 -3437 449 -2988 900000 -5683 105 -1397 -1445 3057 900000 203 -2537 900000 -1884 700 85 942 163 -63 882 -219 1167 477 913 287 255 325 1153 -1681 -447 738 -844 862 2002 -1218 134 382 1550 3 330 809 -324 1554 -1674 1103 -473 1450 1791 731 1363 1323 2130 -901 1021 -801 1923 1245 -215 2322 926 1463 -1802 882 -590 2301 610 661 -101 -1460 283 -766 662 -771 979 -243 407 982 1763 -1234 -706 -718 -926 -766 -1347 -35 -396 -2050 1220 -876 220 -238 -550 -399 -640 887 -1504 654 -1237 -988 -626 694 -69 -2043 -1848 -639 130 1063 2018 1177 -16 768 -514 1246 372 773 56 -494 -498 -290 2378 -1097 1129 -148 1442 2131 392 18 -1681 163 158 -365 -1347 -1199 612 -1076 1502 1113 361 -291 -1459 SS 20230820T112436.8Z 8632.475426 77 1 48.61 2 76.54 85.10 118.78 68.22 0.00 1 0.00 1 0 25 1.353e-01 5.259e-03 1.786e-01 3.427e-03 5.304930e-01 1.921436e-03 6.127119e-03 -6.000000e+00 8.287512e-02 231.44 -2.00 3.51 -2.00 320.71 0.00e+00 2.718486e-03 8.039430e-04 3.030660e-04 -6.000000e+00 3.710177e-03 289.92 -2.00 20.00 -2.00 320.01 0.00e+00 4.189 0.001 302.00 328.00 3 2.7788e+00 6.1834e-03 5.0686e-02 -6.0000e+00 2.0705e-01 2.3015e-02 7.9634e-03 2.8855e-02 -6.0000e+00 2.2279e-01 -3.5630e-03 7.1045e-03 1.4906e-02 -6.0000e+00 1.3292e-01 -1.1464e-02 3.5077e-03 5.8329e-03 -6.0000e+00 5.6796e-02 2.7378e-04 -5.9277e-04 1.1027e-04 6.5778e-05 -6.0000e+00 4.1779e-03 2.6080e-03 -1.3463e-05 11 1 0 11 8 0 99.91 22.05 0.27 0.00261 -0.00185 102 23 1 5 0 476.480 26.73 20.00 22.05 23.45 17.9 1008.71 53069 42878 -6938 8938 -49570 -62 -30313 10690 -46864 -57456 60767 -55457 29290 -45528 -1215 -16822 -1162 -2974 10544 -11365 -11797 7833 -3157 -801 -2965 -7594 -8932 -3224 9211 3641 4045 -853 -1219 3130 -4022 6064 -5211 2608 -2217 953 -3477 780 -2042 -5165 -2083 1107 1230 -25 3054 -135 1455 2623 1334 2109 1118 956 125 1014 1143 1487 2112 3118 2386 1481 -475 900 99 650 205 -38 -162 0 -574 -302 -759 -784 -34 -266 -697 -862 -1020 -1481 -1629 -1885 -1073 -26 -234 554 381 392 971 -415 341 750 952 206 1228 135 -209 -140 -221 -165 745 301 -1155 -1087 -783 7 172 363 324 -8 -243 326 352 679 600 577 -337 -514 -683 98 -64 18 220 -48 677 939 92 -302 -416 -546 -52 72 -111 -182 187 157 -173 -40 111 165 900000 177 164 -45 47 -450 0 -260 69 -593 -806 305 -976 294 -1116 -23 -427 -28 -79 263 -370 -394 222 -106 -28 -114 -318 -378 -126 326 151 194 -46 -73 182 -249 357 -393 218 -234 113 -444 108 -285 -759 -303 168 190 -4 498 -23 269 527 295 494 277 245 33 262 291 383 575 931 797 535 -176 320 35 242 85 -18 -82 0 -290 -143 -331 -312 -13 -105 -311 -446 -604 -981 -1164 -1439 -870 -22 -208 498 337 331 758 -309 246 564 794 197 1326 163 -249 -172 -254 -174 748 315 -1305 -1297 -988 10 237 546 521 -14 -393 498 509 951 857 867 -539 -847 -1120 155 -98 28 328 -69 958 1403 144 -520 -770 -1065 -106 155 -254 -434 456 367 -423 -95 248 354 900000 SS 20230820T113438.4Z 8632.482389 80 1 48.02 2 74.65 86.71 117.10 70.19 0.00 1 0.00 1 0 25 3.455e-01 1.246e-02 2.097e-01 8.388e-03 4.811695e-01 4.653663e-03 5.715583e-03 -6.000000e+00 2.115530e-01 231.44 -2.00 3.51 -2.00 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