File name: Pandora51s1_OldFieldNY_20231129_L2Fit_fout2c5d20211018p1-8.txt File generation date: 20231130T050419.7Z 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_20231129_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: 20231129 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 20231129T130945.2Z 8733.548439 305 1 34.73 2 79.34 131.08 78.79 296.97 0.00 1 0.00 1 0 25 4.967e-01 8.854e-03 3.155e-01 6.007e-03 7.260435e-01 3.426637e-03 8.345014e-03 -6.000000e+00 2.943099e-01 223.03 -2.00 3.51 -2.00 321.38 0.00e+00 4.835939e-03 1.722688e-03 3.234116e-03 -6.000000e+00 1.372308e-02 278.95 -2.00 20.00 -2.00 320.89 0.00e+00 5.199 0.003 302.00 328.00 3 2.4475e+00 1.1822e-02 6.7859e-02 -6.0000e+00 7.2352e-01 1.3250e-01 1.6904e-02 4.8702e-02 -6.0000e+00 7.8531e-01 -1.0299e-01 1.8114e-02 2.1958e-02 -6.0000e+00 4.6882e-01 2.7399e-02 8.5222e-03 9.5565e-03 -6.0000e+00 2.0277e-01 1.1609e-04 -1.5107e-03 1.8102e-04 1.0084e-04 -6.0000e+00 1.5332e-02 1.2132e-02 -1.4857e-04 12 9 1 12 1 1 99.56 22.15 0.40 0.01213 0.00078 42 14 1 5 0 807.360 26.83 20.00 22.15 3.47 17.7 873.65 -224897 900000 -154226 -166713 -204328 -136455 93578 -183468 -148054 -146231 900000 -69628 119360 -97998 -44857 76671 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1050 -412 607 -301 1037 102 -468 301 -1051 -417 -1427 -61 -1074 -171 -925 -570 386 685 1293 -535 916 -280 361 663 68 1576 -146 -67 -1254 552 85 321 -1936 -2096 -1015 -431 742 -1180 -790 -800 347 429 1127 2078 454 847 -837 -1674 -662 85 1265 -422 1158 603 1911 1653 -149 239 -70 134 152 307 -1386 -310 91 -223 -96 -1553 381 811 900000 SS 20231129T131452.5Z 8733.551997 308 1 49.02 2 78.61 132.04 79.62 297.69 0.00 1 0.00 1 0 25 3.963e-01 6.886e-03 1.694e-01 3.263e-03 6.853650e-01 1.833969e-03 7.828566e-03 -6.000000e+00 2.349964e-01 223.03 -2.00 3.51 -2.00 321.26 0.00e+00 3.087521e-03 8.851038e-04 1.855088e-03 -6.000000e+00 1.076402e-02 278.95 -2.00 20.00 -2.00 320.77 0.00e+00 4.896 0.002 302.00 328.00 3 1.9289e+00 6.1139e-03 6.1795e-02 -6.0000e+00 5.7747e-01 9.7334e-02 8.6295e-03 4.0519e-02 -6.0000e+00 6.2676e-01 -7.3171e-02 9.1586e-03 2.0269e-02 -6.0000e+00 3.7405e-01 1.6333e-02 4.3622e-03 7.6917e-03 -6.0000e+00 1.6182e-01 2.7461e-04 -1.3452e-03 9.9481e-05 8.7489e-05 -6.0000e+00 1.2351e-02 1.1446e-02 -1.1857e-04 11 9 0 11 8 0 99.40 22.15 0.25 0.01145 0.00134 120 27 1 5 0 408.040 26.83 20.00 22.15 3.58 17.7 874.53 -167215 900000 -178268 900000 -178550 -76502 -125541 -143212 -72296 -141346 101031 -131057 -43202 -74727 -40664 -27983 -46549 14617 -43107 13597 -31766 -31688 -7501 -33754 -4976 -36395 32376 -21636 -2174 -24973 -9911 -5425 -5163 20088 -10220 18131 -12665 8667 -2004 -1725 4373 -3293 9697 -1441 2863 -3402 3099 4406 1453 4627 3955 3443 2407 1533 1416 -1226 1516 -1139 2404 13 4497 1857 4353 2157 1218 1243 2376 2968 1751 1550 -24 -382 1123 -1419 1814 -1155 193 330 -152 -684 -929 -934 -1956 -472 -1536 -76 -1437 -297 111 -83 1416 396 1089 568 631 356 579 388 -770 -348 -153 549 365 -289 -1198 -1671 -652 -419 227 -234 -115 -360 145 142 535 1206 694 545 -537 -946 -109 -11 565 -137 297 212 1344 599 240 19 -80 30 96 35 -394 -313 80 -97 -169 -219 263 123 900000 -1405 900000 -1814 900000 -1825 -295 -884 -1366 -378 -1605 321 -1750 -334 -1018 -490 -350 -740 149 -786 158 -592 -571 -123 -730 -93 -903 434 -463 -43 -678 -279 -172 -183 566 -388 550 -601 402 -118 -117 309 -269 727 -124 241 -314 278 412 150 509 492 479 371 257 251 -231 282 -214 429 2 851 405 1048 546 319 324 664 832 559 556 -10 -152 425 -511 610 -368 59 109 -55 -292 -460 -519 -1188 -301 -1055 -55 -1079 -223 81 -58 911 245 671 379 480 314 588 440 -922 -403 -163 530 335 -275 -1220 -1805 -744 -519 310 -337 -180 -584 231 218 780 1709 1010 831 -866 -1551 -173 -16 877 -206 428 296 1865 905 387 35 -157 63 210 82 -930 -765 200 -242 -414 -541 607 271 900000 SS 20231129T132002.7Z 8733.555586 311 1 48.74 2 77.89 133.03 80.45 298.42 0.00 1 0.00 1 0 25 3.142e-01 7.176e-03 1.386e-01 2.713e-03 6.439955e-01 1.507037e-03 7.437227e-03 -6.000000e+00 1.861496e-01 223.03 -2.00 3.51 -2.00 321.06 0.00e+00 3.826028e-03 6.925489e-04 1.819653e-03 -6.000000e+00 8.342146e-03 278.95 -2.00 20.00 -2.00 320.55 0.00e+00 4.627 0.002 302.00 328.00 3 1.9466e+00 4.9230e-03 5.8407e-02 -6.0000e+00 4.5768e-01 8.3649e-02 6.6867e-03 3.8392e-02 -6.0000e+00 4.9666e-01 -5.8787e-02 6.8598e-03 1.8599e-02 -6.0000e+00 2.9650e-01 1.0660e-02 3.3149e-03 7.9070e-03 -6.0000e+00 1.2798e-01 3.6349e-04 -1.1910e-03 8.3695e-05 8.4695e-05 -6.0000e+00 9.6769e-03 1.1177e-02 -1.1287e-04 11 8 0 10 0 0 96.12 22.15 0.25 0.01118 0.00223 139 32 1 5 0 350.550 26.83 20.00 22.15 3.74 17.8 875.85 -157294 900000 -112830 -35319 -117365 -152825 -36619 -136383 -8492 -112582 -37990 -70187 -74103 -10643 -61428 36646 -36182 2268 -34086 8722 -4766 -22540 2795 -26899 6283 -29694 -4539 -19573 -20934 9278 -16602 8708 -9887 -573 735 -4867 4177 -5927 6353 -4724 9422 -2075 4458 222 1786 2492 -3225 6377 -4548 4709 2437 4852 2810 2307 3836 -1730 1773 -2828 1520 -910 2209 3531 2280 2303 -37 2933 197 3791 2621 653 1357 -64 488 -1435 486 -966 420 715 -589 -747 -2154 -1118 -2283 -614 -955 -1021 -449 -766 635 -348 1503 521 1198 1230 536 1167 360 356 -546 -230 -37 220 854 -497 -1090 -1497 -370 -745 -30 -117 -452 -318 -203 725 306 1077 747 246 -129 -896 -351 -148 706 -96 89 523 1241 1197 187 105 -421 215 68 34 -405 -347 95 -92 -190 -309 168 249 900000 -1740 900000 -923 -127 -931 -1801 -150 -1705 -33 -1327 -238 -743 -1051 -102 -1211 317 -731 34 -729 138 -88 -515 53 -682 133 -857 -111 -555 -581 239 -608 290 -440 -24 30 -221 199 -376 430 -413 789 -208 437 23 189 269 -381 717 -561 580 343 737 476 422 727 -358 359 -590 299 -186 468 828 610 668 -11 852 60 1183 929 264 583 -28 208 -580 175 -324 135 245 -235 -351 -1183 -679 -1514 -426 -710 -802 -364 -630 506 -265 1052 350 796 875 435 1088 388 396 -638 -261 -42 225 828 -504 -1179 -1717 -447 -908 -40 -174 -728 -527 -331 1120 452 1546 1099 381 -210 -1492 -571 -231 1056 -139 124 756 1783 1719 304 190 -827 444 150 79 -933 -830 232 -226 -456 -709 388 550 900000 SS 20231129T132536.4Z 8733.559449 314 1 38.11 2 77.13 134.10 81.34 299.21 0.00 1 0.00 1 0 25 2.093e-01 5.896e-03 9.137e-02 2.033e-03 6.113466e-01 1.110765e-03 7.083490e-03 -6.000000e+00 1.239882e-01 223.03 -2.00 3.51 -2.00 320.82 0.00e+00 3.571522e-03 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