File name: Pandora166s1_PhiladelphiaPA_20230907_L2Fit_fout2c5d20220925p1-8.txt File generation date: 20230908T084354.5Z 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: 166 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora166_OF_v5d20210217.txt Instrument calibration file used: Pandora166s1_CF_v5d20220925.txt Level 1 file used: Pandora166s1_PhiladelphiaPA_20230907_L1_smca1c5d20220925p1-8.txt Full location name: Philadelphia, Pennsylvania; Philadelphia-Camden-Wilmington; North East Waste (NE Short location name: PhiladelphiaPA Country of location: United States Location latitude [deg]: 39.9919 Location longitude [deg]: -75.0811 Location altitude [m]: 6 Local noon date: 20230907 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: HCHO modification of session 4 "Field cal based on session3" First and last pixel inside fitting window: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0654 305.2061 305.3468 305.4875 305.6282 305.7689 305.9096 306.0503 306.1910 306.3316 306.4722 306.6129 306.7535 306.8941 307.0347 307.1753 307.3158 307.4564 307.5969 307.7375 307.8780 308.0185 308.1590 308.2995 308.4400 308.5805 308.7209 308.8614 309.0018 309.1422 309.2827 309.4231 309.5635 309.7038 309.8442 309.9846 310.1249 310.2652 310.4056 310.5459 310.6862 310.8265 310.9668 311.1070 311.2473 311.3875 311.5278 311.6680 311.8082 311.9484 312.0886 312.2288 312.3690 312.5091 312.6493 312.7894 312.9295 313.0696 313.2097 313.3498 313.4899 313.6300 313.7700 313.9101 314.0501 314.1901 314.3301 314.4701 314.6101 314.7501 314.8901 315.0300 315.1700 315.3099 315.4498 315.5897 315.7296 315.8695 316.0094 316.1493 316.2891 316.4290 316.5688 316.7086 316.8484 316.9882 317.1280 317.2678 317.4076 317.5473 317.6871 317.8268 317.9665 318.1062 318.2459 318.3856 318.5253 318.6650 318.8046 318.9443 319.0839 319.2235 319.3631 319.5027 319.6423 319.7819 319.9215 320.0610 320.2006 320.3401 320.4796 320.6191 320.7586 320.8981 321.0376 321.1770 321.3165 321.4559 321.5954 321.7348 321.8742 322.0136 322.1530 322.2923 322.4317 322.5711 322.7104 322.8497 322.9891 323.1284 323.2677 323.4069 323.5462 323.6855 323.8247 323.9640 324.1032 324.2424 324.3816 324.5208 324.6600 324.7992 324.9383 --------------------------------------------------------------------------------------- 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 20230907T120334.5Z 8650.502483 261 1 50.86 2 73.66 95.89 16.25 221.94 0.00 1 0.00 1 0 17 4.882e-02 5.545e-03 2.011e-02 1.149e-03 4.420812e-01 5.899940e-04 5.040769e-03 -6.000000e+00 2.828852e-02 229.94 -2.00 3.49 -2.00 319.96 0.00e+00 1.640803e-03 1.603162e-04 2.339758e-04 -6.000000e+00 1.128115e-03 289.22 -2.00 20.00 -2.00 319.63 0.00e+00 3.496 0.001 302.00 328.00 3 1.2217e+00 1.6564e-03 4.1883e-02 -6.0000e+00 7.1178e-02 7.6040e-04 1.9450e-03 2.3045e-02 -6.0000e+00 7.7394e-02 -1.3670e-02 1.7664e-03 1.1802e-02 -6.0000e+00 4.5427e-02 -3.7043e-03 9.4276e-04 3.5781e-03 -6.0000e+00 1.8856e-02 2.8625e-03 -1.8520e-04 3.4686e-05 3.9432e-05 -6.0000e+00 1.3435e-03 -1.1699e-02 -1.0320e-05 10 0 0 10 0 0 18.75 19.40 0.18 -0.01170 -0.01309 270 49 1 5 0 188.350 26.21 19.99 19.40 32.72 23.0 1046.57 5983 -16206 -1133 -27697 2085 -31918 5752 -12805 -7496 931 -18723 3741 -15162 4036 -4764 -1030 2156 1102 3524 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760 1139 294 -603 -211 -1024 -757 246 -1524 -1563 -1417 -1057 -487 625 648 172 519 -85 168 375 807 274 223 -197 -918 109 366 491 499 225 146 1678 980 131 91 -745 -271 -25 -381 -448 -525 1002 -122 -111 -122 -545 107 SS 20230907T121009.8Z 8650.507058 265 1 50.46 2 72.41 96.99 17.10 225.95 0.00 1 0.00 1 0 17 2.928e-01 1.060e-02 1.450e-01 5.939e-03 4.233669e-01 3.073250e-03 4.803287e-03 -6.000000e+00 1.697240e-01 229.94 -2.00 3.49 -2.00 320.08 0.00e+00 2.312180e-03 8.467544e-04 2.349028e-04 -6.000000e+00 6.764196e-03 289.22 -2.00 20.00 -2.00 319.74 0.00e+00 3.262 0.001 302.00 328.00 3 3.8590e+00 8.6626e-03 3.9415e-02 -6.0000e+00 4.2707e-01 8.7904e-03 1.0158e-02 2.2056e-02 -6.0000e+00 4.6429e-01 -9.0071e-03 9.1429e-03 1.1322e-02 -6.0000e+00 2.7253e-01 -2.9968e-03 4.8707e-03 3.4519e-03 -6.0000e+00 1.1316e-01 2.5852e-04 3.5486e-04 1.8265e-04 3.8818e-05 -6.0000e+00 8.0555e-03 -9.3338e-03 2.0221e-04 12 9 8 11 8 0 99.97 19.40 0.38 -0.00933 -0.00667 53 10 1 5 0 952.010 26.21 20.00 19.40 33.04 23.1 1049.12 -34933 -13932 -26551 87085 -4650 53742 -36775 292158 11394 -13274 106031 -31088 54300 -12591 -4201 13468 8875 10330 -6044 2449 -11179 11719 9855 11990 -458 622 -888 -5956 5533 -5504 8512 4400 4277 523 -3906 8333 -6175 2958 -7835 -4940 -4264 -2793 -1721 -3070 1543 -1909 4902 -3762 -1065 588 1393 4242 553 3741 931 1779 2162 -1101 -1170 -667 1048 1534 5014 4397 -945 1494 -1296 -717 262 353 -204 2608 1386 -807 1309 -2623 -1314 -5511 673 -1454 -2109 -1811 -2747 -715 -1358 958 967 1358 1703 -335 -466 -2907 -2422 -2593 -466 597 -35 1380 366 763 -258 -465 -1925 -396 -535 -941 68 -722 882 1435 1441 1729 1184 751 -894 325 -1237 440 -514 -456 -614 -120 716 74 668 -593 -818 655 -516 182 -775 -590 -1076 -229 -787 -389 322 973 460 208 601 101 -653 -788 -296 -662 792 -87 585 -922 1692 232 -355 1034 -1052 1021 -499 -182 569 423 519 -373 147 -777 666 585 740 -34 47 -69 -471 382 -429 643 388 420 56 -421 789 -722 368 -1289 -928 -885 -607 -387 -717 349 -452 1092 -913 -254 143 360 1165 170 1190 318 620 768 -405 -424 -239 381 600 2095 2018 -470 696 -590 -323 125 191 -122 1599 861 -493 731 -1380 -626 -2660 325 -818 -1361 -1304 -2162 -581 -1185 875 930 1348 1694 -330 -432 -2552 -1982 -2091 -394 558 -37 1613 465 970 -314 -522 -2044 -418 -608 -1137 86 -961 1228 2149 2313 2869 1953 1187 -1344 458 -1759 639 -799 -749 -1027 -196 1137 115 985 -850 -1128 898 -771 295 -1352 -1073 -2027 -445 -1627 -843 712 2182 1042 462 1280 207 -1317 SS 20230907T121458.0Z 8650.510394 268 1 50.68 2 71.50 97.80 17.76 228.65 0.00 1 0.00 1 0 17 2.606e-02 5.932e-03 1.492e-02 1.261e-03 3.963930e-01 6.482020e-04 4.604204e-03 -6.000000e+00 1.509697e-02 229.94 -2.00 3.49 -2.00 319.56 0.00e+00 1.342394e-03 1.556510e-04 1.784028e-04 -6.000000e+00 6.023261e-04 289.22 -2.00 20.00 -2.00 319.23 0.00e+00 3.111 0.000 302.00 328.00 3 1.8776e+00 1.7945e-03 3.7387e-02 -6.0000e+00 3.7985e-02 -1.3050e-03 2.0576e-03 2.0668e-02 -6.0000e+00 4.1307e-02 -8.1974e-03 1.6948e-03 1.0450e-02 -6.0000e+00 2.4245e-02 -5.4622e-03 9.0828e-04 3.1121e-03 -6.0000e+00 1.0061e-02 2.2722e-03 -5.4684e-04 3.8072e-05 3.5249e-05 -6.0000e+00 7.1729e-04 -1.1636e-02 -8.9296e-05 10 0 0 10 0 0 98.93 19.40 0.24 -0.01164 -0.01575 172 31 1 5 0 294.620 26.21 20.00 19.40 33.17 23.0 1049.68 2457 -9755 -7361 -6075 -9489 -9123 -12770 -5758 -6864 -664 -7870 -6110 -3114 -6215 2613 -169 266 -89 3107 1860 -1084 2792 -1594 1758 525 -909 -2209 -2682 762 -541 2925 807 2468 -899 -3786 -2282 -4127 -509 -1426 -1219 -1498 -1331 -1050 -1772 -45 -448 -348 -1066 -925 218 189 518 489 1356 -72 684 247 -459 -170 3 1105 1295 1983 2092 436 26 -7 207 1159 1272 602 877 361 592 -3 -351 -10 -644 258 -706 -1077 -1302 -2268 -1625 -712 -445 -240 318 666 742 832 965 1028 924 831 132 520 1010 -29 -371 -484 -693 -340 229 -1188 -1568 -1033 -1057 -245 -54 68 -164 -48 -141 -27 771 553 467 362 -139 -568 -115 435 162 571 278 364 1532 605 268 -33 -168 -138 339 -39 -185 -96 184 -130 -262 -171 -411 111 53 -269 -208 -163 -240 -222 -343 -163 -221 -21 -279 -210 -122 -301 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