File name: Pandora51s1_OldFieldNY_20250611_L2Fit_fout2c5d20211018p1-8.txt File generation date: 20250612T050534.3Z 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_20250611_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: 20250611 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 20250611T103821.2Z 9293.443301 216 1 49.47 2 77.58 70.06 105.71 245.34 0.00 1 0.00 1 0 17 5.722e-01 2.005e-02 3.428e-01 1.174e-02 6.029629e-01 6.802955e-03 6.954568e-03 -6.000000e+00 3.520752e-01 232.70 -2.00 3.51 -2.00 321.13 0.00e+00 1.151411e-02 3.151030e-03 1.160395e-03 -6.000000e+00 1.675837e-02 286.29 -2.00 20.00 -2.00 320.53 0.00e+00 4.516 0.002 302.00 328.00 3 4.2527e+00 2.3008e-02 5.8013e-02 -6.0000e+00 8.8507e-01 1.9725e-01 2.9834e-02 4.0543e-02 -6.0000e+00 9.5435e-01 -2.2342e-01 2.6913e-02 1.9370e-02 -6.0000e+00 5.6649e-01 8.8866e-02 1.2981e-02 1.6046e-02 -6.0000e+00 2.4184e-01 3.9429e-05 -1.5113e-03 3.7441e-04 1.5748e-04 -6.0000e+00 1.7785e-02 1.3608e-02 -1.2685e-04 12 8 8 10 0 0 65.01 22.41 0.45 0.01361 0.00225 15 3 1 5 0 3297.320 27.05 20.00 22.41 22.34 23.6 1026.40 900000 -209451 147084 -147966 273569 112038 -162942 -41390 -95242 900000 -58274 900000 279744 -58900 -2005 2427 52463 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329 3951 144 3760 -557 2454 -221 1697 2341 -1191 3666 -2076 1474 -1501 -1328 394 -1385 714 -3180 -655 -3047 30 -281 748 2125 -1170 2985 -2912 1584 -2254 577 -2698 -2373 1428 234 301 -972 1016 -1984 1282 -775 -3856 774 -1270 297 -2251 308 1461 -2046 -50 1297 469 -3006 951 918 1187 -2500 -2368 3390 252 2014 1386 2805 770 1516 1067 680 1674 -252 389 -1602 2757 -1308 406 920 -645 291 -4291 -410 900000 SS 20250611T104433.1Z 9293.447605 219 1 48.59 2 76.48 70.98 106.73 246.19 0.00 1 0.00 1 0 17 3.421e-01 9.558e-03 3.134e-01 7.853e-03 5.949420e-01 4.486793e-03 6.873823e-03 -6.000000e+00 2.116923e-01 232.70 -2.00 3.51 -2.00 320.94 0.00e+00 3.116616e-03 1.974634e-03 1.143976e-03 -6.000000e+00 9.394571e-03 286.29 -2.00 20.00 -2.00 320.32 0.00e+00 4.172 0.001 302.00 328.00 3 4.0369e+00 1.4758e-02 5.3043e-02 -6.0000e+00 5.3169e-01 1.0814e-01 1.9302e-02 3.2842e-02 -6.0000e+00 5.7265e-01 -8.7371e-02 1.8015e-02 1.7460e-02 -6.0000e+00 3.3917e-01 2.3520e-02 8.7533e-03 6.0983e-03 -6.0000e+00 1.4357e-01 7.0441e-05 -8.2784e-04 2.4930e-04 8.3125e-05 -6.0000e+00 1.0781e-02 1.1932e-02 -5.8261e-05 12 8 8 10 0 0 96.23 22.41 0.34 0.01193 0.00571 24 5 1 5 0 2023.840 27.05 20.01 22.41 22.81 23.7 1030.54 2051 -87854 900000 -146008 -31186 58682 900000 -82088 -79542 -93730 -81500 124489 34625 24640 -13120 138467 68569 -21974 107761 -31950 108531 -55879 137750 -43011 -12321 1908 15176 -11724 4872 37444 2384 1754 -6330 -20749 -14409 -650 3073 -7950 4375 1866 2405 1928 -1224 874 -7785 7722 -5845 10604 10216 -5147 1923 755 -1278 -2778 2950 -1559 2876 1776 -8323 1820 5126 10860 3302 4344 -1980 1092 643 -125 3988 -1502 4153 2883 3529 1233 37 8 -1715 -3051 1223 -1107 471 -3989 -994 -2481 1021 -108 912 -325 544 335 -2364 -1247 -182 860 -376 1107 81 -1 -309 -131 -514 -417 910 -924 -1796 -1464 -408 -802 557 752 -732 67 -292 714 497 465 673 457 579 -920 -41 -62 318 256 496 -120 970 1279 -368 571 324 -20 -77 -579 -337 -569 -198 316 281 181 -355 23 900000 16 -890 900000 -2500 -239 449 900000 -951 -987 -1435 -1214 953 265 246 -225 1060 685 -562 872 -1004 926 -2281 1054 -1773 -407 56 402 -390 142 914 95 79 -339 -1270 -840 -35 183 -619 362 182 256 213 -145 104 -1027 913 -790 1290 1316 -819 316 138 -259 -612 643 -367 656 404 -2065 414 1205 2680 980 1370 -671 352 209 -43 1491 -648 1856 1328 1566 523 15 3 -604 -1149 503 -543 261 -2567 -653 -1761 748 -85 735 -269 438 262 -1776 -874 -124 618 -308 1000 84 -1 -372 -153 -557 -415 878 -940 -1914 -1641 -481 -1022 767 1138 -1177 110 -469 1108 734 673 992 708 943 -1553 -68 -99 489 377 698 -168 1343 1842 -597 1011 605 -40 -161 -1285 -791 -1357 -480 770 674 424 -794 49 900000 SS 20250611T112445.9Z 9293.475531 238 1 15.57 2 69.18 76.93 113.54 251.62 0.00 1 0.00 1 0 17 6.947e-02 8.409e-03 6.566e-02 5.681e-03 4.067934e-01 3.071345e-03 4.742125e-03 -6.000000e+00 4.269185e-02 232.70 -2.00 3.51 -2.00 319.21 0.00e+00 1.260800e-03 7.788813e-04 2.912304e-04 -6.000000e+00 1.876425e-03 286.29 -2.00 20.00 -2.00 318.46 0.00e+00 2.786 0.000 302.00 328.00 3 4.7788e+00 8.6200e-03 3.5457e-02 -6.0000e+00 1.0712e-01 3.4341e-02 1.0003e-02 2.1636e-02 -6.0000e+00 1.1529e-01 -9.3002e-03 7.3489e-03 1.0680e-02 -6.0000e+00 6.8552e-02 -4.3522e-03 3.8256e-03 3.2638e-03 -6.0000e+00 2.9060e-02 1.6172e-04 -7.6961e-05 1.8076e-04 3.8471e-05 -6.0000e+00 2.1460e-03 1.1455e-02 -3.2574e-05 12 9 1 12 1 1 99.83 22.42 0.28 0.01146 0.01088 6 5 1 5 0 2222.270 27.05 20.00 22.42 24.58 23.6 1041.17 8240 36297 34465 -14232 -20516 -10276 -18640 25812 -14711 212 -22380 -4046 -12653 -2139 11675 -4612 9101 -2222 4596 -1622 3278 8724 3189 8870 -9064 3913 -3105 -3711 -1527 -7959 12098 -17104 7248 -1928 1199 -5621 1992 3772 -2341 3046 -3991 905 -2400 126 357 -484 -518 -1489 -814 697 -1241 -288 404 2968 1062 1761 -81 -648 -860 -577 508 1702 2192 -18 1048 -699 1793 466 2002 1541 232 537 1348 437 -768 60 -509 -1279 -1007 -2552 -437 -1951 -1129 -1605 14 -1111 -229 287 274 808 1614 258 -83 451 1450 -4 1563 54 357 -1580 -672 260 590 -191 -2021 -1036 -416 185 269 88 105 -415 116 -197 173 174 551 751 378 -524 -1000 972 -187 523 131 600 491 1032 -71 -179 332 -1176 -268 610 -130 15 -288 365 183 127 -349 -431 900000 194 711 685 -410 -614 -286 -607 634 -561 7 -1016 -173 -684 -124 679 -349 646 -188 382 -148 290 747 304 853 -1072 426 -355 -410 -165 -977 1356 -2785 1014 -288 174 -900 337 748 -572 801 -1218 276 -777 40 114 -157 -168 -489 -271 242 -476 -115 172 1300 491 830 -39 -312 -410 -279 258 931 1270 -11 630 -408 1021 273 1279 1075 175 412 1001 315 -512 37 -298 -773 -658 -1928 -356 -1734 -1062 -1580 15 -1209 -257 325 305 864 1584 243 -76 422 1443 -5 1882 71 477 -2085 -835 303 668 -229 -2570 -1348 -568 260 400 139 173 -689 184 -301 252 250 790 1131 595 -843 -1614 1529 -288 779 190 832 685 1473 -108 -291 557 -2040 -479 1117 -249 31 -578 737 367 249 -670 -800 900000 SS 20250611T113507.9Z 9293.482730 241 1 34.77 2 67.27 78.46 115.32 253.00 0.00 1 0.00 1 0 17 2.050e-02 5.144e-03 1.167e-02 1.312e-03 3.800067e-01 7.060205e-04 4.459306e-03 -6.000000e+00 1.260026e-02 232.70 -2.00 3.51 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