File name: Pandora51s1_OldFieldNY_20240913_L2Fit_fout2c5d20211018p1-8.txt File generation date: 20240914T045516.2Z 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 v1.8.59 Instrument operation file used: Pandora51_OF_v5d20190801.txt Instrument calibration file used: Pandora51s1_CF_v5d20211018.txt Level 1 file used: Pandora51s1_OldFieldNY_20240913_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: 20240913 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 20240913T114458.3Z 9022.489564 75 1 47.87 2 77.04 96.72 162.09 314.05 0.00 1 0.00 1 0 17 4.297e-01 1.881e-02 3.521e-01 1.311e-02 6.009669e-01 7.555791e-03 6.887582e-03 -6.000000e+00 2.632874e-01 229.35 -2.00 3.51 -2.00 321.13 0.00e+00 -5.732966e-04 3.555084e-03 4.900203e-04 -6.000000e+00 1.294584e-02 288.01 -2.00 20.00 -2.00 320.50 0.00e+00 4.340 0.001 302.00 328.00 3 4.6278e+00 2.5884e-02 5.4049e-02 -6.0000e+00 6.5536e-01 8.8074e-02 3.4125e-02 3.2595e-02 -6.0000e+00 7.0810e-01 -1.8514e-01 3.0517e-02 1.6515e-02 -6.0000e+00 4.2064e-01 7.8905e-02 1.4616e-02 4.7931e-03 -6.0000e+00 1.7975e-01 3.5234e-05 -9.0937e-04 4.2601e-04 6.5971e-05 -6.0000e+00 1.3545e-02 1.2231e-02 -1.2514e-04 12 9 8 11 8 0 99.88 22.13 0.46 0.01223 0.00540 15 3 1 5 0 3190.710 26.83 20.00 22.13 20.78 21.7 993.34 -89092 41731 -83160 -180278 123837 -140730 900000 -3424 -149012 900000 -173877 900000 -67980 900000 -16038 -12968 31102 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-1939 3735 2810 2062 5 -233 -47 475 -1303 -1181 -217 -1009 866 -1407 -790 -1640 -3042 -1341 -2915 2636 -634 1279 77 1133 -1034 664 761 18 1295 -1379 -614 -1107 -1834 1634 -3527 1319 622 -3065 -442 362 -1093 -3403 657 -1377 -49 1270 -905 2320 1054 1319 671 -571 -162 692 1198 1478 -629 -345 1755 -72 5832 1377 -1283 -1401 1168 1343 -2630 1810 -1902 467 -560 1937 -1529 -1320 -809 900000 SS 20240913T120454.2Z 9022.503405 81 1 48.41 2 73.32 100.14 164.35 326.30 0.00 1 0.00 1 0 25 1.950e-01 9.984e-03 1.433e-01 5.297e-03 4.791729e-01 2.902237e-03 5.642544e-03 -6.000000e+00 1.183542e-01 229.35 -2.00 3.51 -2.00 320.30 0.00e+00 2.654094e-03 1.051631e-03 4.656281e-04 -6.000000e+00 5.305370e-03 288.01 -2.00 20.00 -2.00 319.59 0.00e+00 3.428 0.001 302.00 328.00 3 4.4977e+00 8.8433e-03 4.2911e-02 -6.0000e+00 2.9434e-01 1.6741e-02 1.0899e-02 2.6227e-02 -6.0000e+00 3.1746e-01 -1.8392e-02 9.1286e-03 1.2869e-02 -6.0000e+00 1.8952e-01 -3.9740e-04 4.6202e-03 5.0484e-03 -6.0000e+00 8.1046e-02 1.0757e-04 -9.4757e-04 1.7052e-04 5.5465e-05 -6.0000e+00 6.0180e-03 1.0397e-02 -9.9855e-05 12 8 8 10 0 0 95.35 22.14 0.25 0.01040 0.00328 22 5 1 5 0 2200.010 26.83 19.99 22.14 21.55 21.8 998.70 -86508 28803 -104968 23996 -57128 -36901 34036 -46188 67143 -68875 43944 -56660 22762 -35389 -15264 20126 -13974 -22104 -6301 22952 -21252 33169 -5560 5797 39894 -19224 20767 -7721 -804 1388 352 -18758 13673 8454 -14276 9256 -1169 6797 -784 192 -3600 -2561 1928 -5058 9055 -705 7139 3421 -780 -123 1029 7403 -341 4838 -1410 2057 3373 -203 938 -2133 4126 -1422 4283 509 -936 3750 2643 2112 -434 320 -396 55 1023 -92 -2239 -2486 1598 -603 1513 -265 -1171 -1607 -2354 -1816 -1573 -456 -1427 209 707 1041 868 1063 2129 1325 1957 1277 68 174 -1221 0 -1337 994 -83 -48 -1881 -1165 -861 -497 243 -406 -394 -517 -339 485 818 1119 451 989 238 -941 -68 -235 225 -381 855 918 1200 898 247 100 144 377 443 98 -453 -468 162 -608 -323 -443 241 294 900000 -1910 237 -3002 198 -961 -537 283 -887 491 -1868 448 -1697 396 -1244 -532 556 -579 -1072 -276 800 -1143 1088 -277 276 1463 -1279 939 -441 -45 80 23 -1675 982 644 -1344 725 -116 727 -108 30 -636 -473 352 -1009 1591 -138 1307 662 -163 -27 247 1815 -97 1393 -450 652 1067 -66 297 -708 1369 -550 1723 225 -418 1542 1088 914 -214 175 -228 32 590 -50 -1146 -1164 686 -274 754 -155 -783 -1165 -1842 -1504 -1390 -422 -1390 203 673 937 727 851 1639 1072 1744 1269 77 212 -1562 0 -1582 1061 -87 -52 -2219 -1439 -1097 -674 355 -648 -651 -867 -551 756 1198 1590 658 1507 386 -1590 -113 -381 352 -574 1247 1288 1662 1316 389 172 258 704 863 203 -974 -1047 368 -1410 -737 -975 514 602 900000 SS 20240913T121134.5Z 9022.508039 85 1 11.87 2 72.08 101.31 164.96 331.07 0.00 1 0.00 1 0 25 1.245e-01 7.702e-03 1.250e-01 5.453e-03 4.585366e-01 2.937046e-03 5.389270e-03 -6.000000e+00 7.559226e-02 229.35 -2.00 3.51 -2.00 319.64 0.00e+00 2.509247e-03 8.762288e-04 2.974830e-04 -6.000000e+00 3.388566e-03 288.01 -2.00 20.00 -2.00 318.89 0.00e+00 3.206 0.001 302.00 328.00 3 4.0891e+00 8.4329e-03 4.0302e-02 -6.0000e+00 1.8799e-01 2.1229e-02 1.0068e-02 2.4610e-02 -6.0000e+00 2.0276e-01 -7.2889e-04 7.9984e-03 1.2156e-02 -6.0000e+00 1.2105e-01 -1.1544e-02 4.1533e-03 4.6114e-03 -6.0000e+00 5.1764e-02 2.0346e-04 -8.5739e-04 1.7092e-04 4.9052e-05 -6.0000e+00 3.8437e-03 1.0367e-02 -1.0322e-04 12 9 1 12 9 1 90.19 22.14 0.29 0.01037 0.00392 7 7 1 5 0 1482.750 26.83 20.00 22.14 21.88 21.8 1000.94 1020 3207 -41962 121310 -6421 20010 -19244 -10242 -20108 -5920 -564 -22774 26530 109 -7464 -24571 17559 9352 1206 -11689 6137 9844 3043 -3201 -362 -4918 -10628 -10547 3339 -3334 -2101 6312 -164 247 -1488 1002 -531 6068 1883 -2128 -3375 -1013 -3374 -1265 -332 -1746 466 -4442 3596 2312 1557 898 896 4194 313 509 -2207 2082 -257 -12 -362 2971 23 993 -1000 33 559 1142 2495 1100 -857 707 143 1270 -723 465 -314 -381 1259 -1245 -486 -2837 -1741 -599 -694 -592 -317 805 76 848 599 1456 1763 593 606 -345 1114 -466 155 -621 -1024 91 -26 20 -1201 -768 -557 130 -392 -142 -961 -748 211 211 1124 886 749 668 -188 -551 -314 157 -335 557 747 -286 955 766 757 -60 -217 -330 325 398 250 -413 -175 -210 -195 -803 -134 648 900000 15 50 -997 645 -102 253 -384 -210 -496 -134 -13 -730 650 4 -346 -1519 799 483 71 -819 365 579 202 -242 -28 -411 -928 -894 249 -289 -205 637 -19 29 -174 120 -72 916 353 -462 -806 -249 -879 -328 -87 -466 123 -1245 960 666 493 311 325 1560 126 210 -944 844 -105 -5 -160 1402 12 541 -550 17 295 609 1456 707 -601 497 99 835 -443 264 -171 -214 757 -858 -376 -2421 -1573 -555 -689 -608 -337 861 81 864 569 1310 1531 542 597 -379 1329 -606 207 -809 -1275 106 -29 24 -1490 -978 -748 181 -580 -222 -1568 -1231 340 328 1666 1279 1103 1013 -298 -903 -510 252 -525 845 1082 -411 1341 1110 1171 -100 -375 -596 596 756 493 -852 -362 -439 -411 -1638 -265 1247 900000 SS 20240913T121608.1Z 9022.511205 88 1 49.16 2 71.24 102.12 165.33 334.53 0.00 1 0.00 1 0 25 9.147e-02 7.013e-03 1.060e-01 5.747e-03 4.393956e-01 3.123678e-03 5.193090e-03 -6.000000e+00 5.553183e-02 229.34 -2.00 3.51 -2.00 320.02 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