File name: Pandora51s1_OldFieldNY_20241120_L2Fit_fout2c5d20211018p1-8.txt File generation date: 20241121T045212.1Z 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 v1.8.60 Instrument operation file used: Pandora51_OF_v5d20190801.txt Instrument calibration file used: Pandora51s1_CF_v5d20211018.txt Level 1 file used: Pandora51s1_OldFieldNY_20241120_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: 20241120 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 20241120T140046.3Z 9090.583869 334 1 49.11 2 70.98 140.86 63.09 279.63 0.00 1 0.00 1 0 17 6.606e-02 8.421e-03 5.311e-02 6.401e-03 3.557801e-01 3.347826e-03 4.269199e-03 -6.000000e+00 3.919366e-02 223.14 -2.00 3.51 -2.00 319.18 0.00e+00 2.332846e-04 8.207242e-04 4.065751e-04 -6.000000e+00 1.736146e-03 279.83 -2.00 20.00 -2.00 318.55 0.00e+00 3.032 0.000 302.00 328.00 3 5.3335e+00 9.2095e-03 3.5198e-02 -6.0000e+00 9.6369e-02 7.7888e-02 1.0657e-02 1.8341e-02 -6.0000e+00 1.0451e-01 -1.2474e-02 7.7428e-03 9.1966e-03 -6.0000e+00 6.2382e-02 -2.4804e-03 4.0553e-03 2.6926e-03 -6.0000e+00 2.6839e-02 7.9677e-05 -4.0697e-04 2.0850e-04 3.4905e-05 -6.0000e+00 2.0342e-03 7.2188e-03 2.6909e-05 11 9 0 11 8 0 99.01 22.26 0.19 0.00722 0.00416 16 4 1 5 0 3068.540 26.94 20.00 22.26 17.69 21.7 973.66 9266 -31395 -8138 -39592 -27199 7176 -13587 -6466 29538 -1550 3394 -8137 -14539 15358 -5799 725 468 5531 4134 -1712 -520 6111 -4929 4717 2096 -11933 4085 -5437 -8391 7854 1839 8108 -1389 -4682 -1632 -4112 909 315 -1035 -237 209 -2147 2100 3172 1570 -531 -958 2541 -4298 3817 -1525 1892 1196 1238 3468 -678 1005 -1829 537 -98 3168 2643 2410 -655 -524 -30 -377 630 2378 -11 94 -1899 609 -973 -901 283 -1299 -213 -28 -605 -1214 -1831 -2296 -377 176 -1430 839 439 970 138 928 -64 723 650 405 877 611 499 219 -550 -1039 147 -422 -887 -1808 -1544 -331 -634 984 -141 68 198 -362 177 -88 616 1230 456 1 -556 97 65 739 761 590 -508 878 995 -329 -210 -214 -155 314 -471 -317 63 401 -454 219 -160 -347 36 900000 298 -1539 -321 -1989 -1137 223 -570 -275 979 -71 158 -460 -1019 932 -485 62 43 507 401 -181 -55 616 -583 539 259 -1733 506 -705 -1097 913 249 1132 -222 -770 -260 -700 167 67 -265 -68 65 -713 685 1031 519 -179 -321 818 -1500 1284 -582 749 508 553 1566 -327 480 -889 251 -47 1539 1402 1389 -406 -317 -17 -214 364 1484 -8 69 -1464 448 -687 -596 168 -736 -121 -17 -426 -964 -1565 -2100 -359 178 -1559 931 497 1075 146 902 -59 637 585 397 933 728 649 293 -720 -1274 166 -466 -1027 -2254 -2021 -451 -916 1459 -227 113 332 -586 273 -127 854 1721 676 2 -895 156 105 1144 1125 833 -694 1190 1399 -492 -337 -362 -265 551 -876 -622 129 832 -940 457 -325 -676 67 900000 SS 20241120T140705.5Z 9090.588259 338 1 48.07 2 70.24 142.22 64.24 280.51 0.00 1 0.00 1 0 17 5.080e-02 8.447e-03 4.023e-02 5.377e-03 3.396561e-01 2.808891e-03 4.107567e-03 -6.000000e+00 3.013272e-02 223.14 -2.00 3.51 -2.00 319.03 0.00e+00 1.261708e-03 6.574288e-04 1.260137e-04 -6.000000e+00 1.335296e-03 279.83 -2.00 20.00 -2.00 318.38 0.00e+00 2.926 0.000 302.00 328.00 3 5.1732e+00 7.6808e-03 3.3873e-02 -6.0000e+00 7.4088e-02 7.8257e-02 8.8435e-03 1.7532e-02 -6.0000e+00 8.0359e-02 -2.3788e-02 6.2626e-03 8.8088e-03 -6.0000e+00 4.7964e-02 1.2487e-03 3.2734e-03 2.8240e-03 -6.0000e+00 2.0629e-02 1.0629e-04 -5.3381e-04 1.7562e-04 3.5797e-05 -6.0000e+00 1.5645e-03 7.5873e-03 -5.3783e-05 11 8 0 10 0 0 96.67 22.26 0.17 0.00759 0.00358 15 3 1 5 0 3204.330 26.94 20.00 22.26 17.39 21.7 971.89 -12566 12629 -3482 12303 474 -29078 2502 -21475 18708 -9838 3769 -9514 -9660 -3724 1216 2573 -9127 1304 -1076 -183 11268 -9010 1205 -5683 3709 -8865 1974 3440 207 1293 -2752 18596 -3597 -3615 -6708 -469 1694 -3562 3164 -2117 57 3251 1420 -743 -1616 1329 -26 18 -922 5377 -372 -732 2573 -798 1746 277 1282 -1671 -294 -1013 452 2079 427 3667 -2720 818 273 926 1204 288 1213 -529 712 -968 501 -275 1020 184 -262 -1279 -2299 -193 -1587 113 -776 -45 -279 -1075 512 -198 1261 291 170 -135 -48 1630 201 -173 -627 -369 -64 -301 1032 -1917 -379 -1136 -34 265 840 393 -386 -499 -843 1465 312 568 -30 413 -2 -756 -448 -375 727 158 692 11 1055 1243 416 -325 -566 203 398 92 323 -514 -85 -96 253 -129 -289 -409 900000 -579 481 -154 440 18 -1466 103 -1214 782 -553 191 -612 -724 -307 109 242 -1023 139 -122 -22 1198 -1162 150 -802 498 -1375 268 438 27 173 -419 2505 -643 -641 -1193 -82 326 -855 838 -669 19 1094 499 -269 -591 471 -9 6 -331 1893 -149 -315 1137 -382 841 138 638 -846 -145 -510 237 1164 263 2273 -1753 480 156 539 768 205 915 -415 539 -704 329 -169 581 107 -167 -931 -1848 -166 -1474 109 -810 -49 -312 -1235 570 -215 1248 269 153 -124 -47 1749 238 -224 -837 -475 -78 -345 1138 -2279 -473 -1470 -46 377 1265 636 -641 -829 -1380 2190 441 792 -42 601 -3 -1229 -730 -598 1110 238 987 15 1405 1717 623 -513 -942 347 700 172 616 -1029 -173 -199 518 -257 -554 -776 900000 SS 20241120T141552.8Z 9090.594361 344 1 48.95 2 69.25 144.15 65.84 281.73 0.00 1 0.00 1 0 25 1.380e-02 5.870e-03 2.912e-03 4.611e-04 3.252745e-01 2.391098e-04 3.917725e-03 -6.000000e+00 8.186413e-03 223.14 -2.00 3.51 -2.00 318.74 0.00e+00 7.373512e-04 5.156065e-05 1.159883e-04 -6.000000e+00 3.626580e-04 279.83 -2.00 20.00 -2.00 318.08 0.00e+00 2.795 0.000 302.00 328.00 3 1.1625e+00 6.4639e-04 3.2331e-02 -6.0000e+00 2.0129e-02 1.1171e-02 7.3939e-04 1.6667e-02 -6.0000e+00 2.1830e-02 -1.0065e-02 5.0594e-04 8.3368e-03 -6.0000e+00 1.3030e-02 -3.2282e-03 2.6393e-04 2.5389e-03 -6.0000e+00 5.6056e-03 7.0311e-03 -3.2509e-04 1.4912e-05 3.1241e-05 -6.0000e+00 4.2492e-04 7.4508e-03 1.4466e-05 10 0 0 10 0 0 99.95 22.26 0.23 0.00745 0.00501 926 210 1 5 0 52.740 26.94 20.00 22.26 17.00 21.8 969.94 -2762 -3793 -4802 -7155 -2440 -3610 -1339 -2609 -3573 -4220 -3908 -1157 -1563 -391 -626 -830 -433 464 400 -184 148 290 1132 -465 -584 -1740 -2491 -1209 -460 1114 1391 868 -440 -2415 -1653 -579 -223 -244 -603 -1218 -1384 -944 -1072 -571 -571 -551 -585 -337 121 1176 1076 917 1117 850 923 692 372 348 700 1367 1590 1835 1190 374 -492 93 886 1292 1449 437 -52 -119 -120 -133 -320 22 239 623 274 -506 -1136 -1537 -1662 -1039 -752 -645 -383 -220 -139 -2 497 659 1153 1415 776 688 481 46 -740 -665 -328 201 695 -14 -925 -1052 -618 -336 32 -18 -353 -344 -84 199 702 960 866 344 -148 -675 -531 -111 156 307 404 523 1235 1319 393 -70 -299 -106 255 114 -120 -324 53 -83 -319 -215 -163 -11 900000 -136 -201 -254 -359 -110 -167 -66 -145 -217 -268 -256 -81 -127 -37 -67 -97 -53 59 53 -25 21 41 166 -73 -97 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