File name: Pandora81s1_StocktonIL_20250513_L2Fit_fout2c2d20240325p1-8.txt File generation date: 20250521T140943.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Alexander Cede Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 81 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora81_OF_v4d20230613.txt Instrument calibration file used: Pandora81s1_CF_v2d20240325.txt Level 1 file used: Pandora81s1_StocktonIL_20250513_L1_smca1c2d20240325p1-8.txt Full location name: CASTNET Site STK138 Short location name: StocktonIL Country of location: United States Location latitude [deg]: 42.2872 Location longitude [deg]: -90.0000 Location altitude [m]: 281 Local noon date: 20250513 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OoB session based off of session 1 lab analysis First and last pixel inside fitting window: 197 339 Nominal wavelengths inside fitting window [nm]: 305.1283 305.2686 305.4090 305.5494 305.6897 305.8300 305.9703 306.1106 306.2509 306.3912 306.5315 306.6717 306.8120 306.9522 307.0924 307.2327 307.3729 307.5131 307.6532 307.7934 307.9336 308.0737 308.2139 308.3540 308.4941 308.6342 308.7743 308.9144 309.0544 309.1945 309.3345 309.4746 309.6146 309.7546 309.8946 310.0346 310.1746 310.3146 310.4545 310.5945 310.7344 310.8743 311.0142 311.1541 311.2940 311.4339 311.5738 311.7136 311.8535 311.9933 312.1331 312.2729 312.4128 312.5525 312.6923 312.8321 312.9718 313.1116 313.2513 313.3910 313.5307 313.6704 313.8101 313.9498 314.0895 314.2291 314.3688 314.5084 314.6480 314.7876 314.9272 315.0668 315.2064 315.3460 315.4855 315.6250 315.7646 315.9041 316.0436 316.1831 316.3226 316.4621 316.6015 316.7410 316.8804 317.0198 317.1592 317.2986 317.4380 317.5774 317.7168 317.8561 317.9955 318.1348 318.2742 318.4135 318.5528 318.6921 318.8313 318.9706 319.1099 319.2491 319.3883 319.5276 319.6668 319.8060 319.9452 320.0843 320.2235 320.3626 320.5018 320.6409 320.7800 320.9191 321.0582 321.1973 321.3364 321.4755 321.6145 321.7535 321.8926 322.0316 322.1706 322.3096 322.4486 322.5875 322.7265 322.8654 323.0044 323.1433 323.2822 323.4211 323.5600 323.6989 323.8377 323.9766 324.1154 324.2542 324.3931 324.5319 324.6707 324.8094 324.9482 --------------------------------------------------------------------------------------- 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 20250513T112954.3Z 9264.479101 204 1 54.84 2 82.37 71.87 97.65 242.17 0.00 1 0.00 1 0 25 5.565e-01 2.482e-02 2.144e-01 4.834e-03 8.854963e-01 2.691475e-03 9.738696e-03 -6.000000e+00 3.263463e-01 230.70 -2.00 3.53 -2.00 321.79 0.00e+00 4.742049e-03 1.441175e-03 1.425698e-03 -6.000000e+00 1.474305e-02 281.05 -2.00 20.00 -2.00 321.30 0.00e+00 7.001 0.006 302.00 328.00 3 1.5443e+00 9.8658e-03 8.4361e-02 -6.0000e+00 8.2119e-01 7.7156e-01 1.3664e-02 5.2538e-02 -6.0000e+00 8.9259e-01 -1.0564e+00 1.3270e-02 2.5380e-02 -6.0000e+00 5.2455e-01 4.2995e-01 6.1586e-03 9.9060e-03 -6.0000e+00 2.1984e-01 5.1607e-05 -1.2183e-03 1.2558e-04 1.1439e-04 -6.0000e+00 1.5570e-02 9.3388e-03 3.6578e-05 12 8 8 10 0 0 51.47 26.51 0.56 0.00934 0.00018 68 6 1 5 0 806.290 34.75 20.07 26.51 24.62 1.1 953.09 -164697 -183230 -137550 -87500 -57715 -137916 900000 900000 -148390 -126131 900000 -61598 1577 205543 -27359 -50001 900000 -23991 -28761 -49070 204583 900000 -115928 131396 -66881 -74292 45231 25055 900000 45609 18952 -35117 177213 14903 -73094 -10716 67760 24108 69034 46647 118214 4781 100805 -24995 49054 71021 42956 -8752 77538 74124 19808 33862 17701 43729 59041 46324 6462 17393 -40458 7077 22692 38581 20223 30199 18284 11058 39514 8156 12114 7167 14050 12375 10088 6331 15166 5880 -780 -872 -10485 -2735 -7296 3855 6326 2681 -2559 4744 1256 -1979 234 -359 3298 -92 -305 -4284 -3001 -2299 2078 -3057 -657 -4043 -720 -3773 -1888 768 -1931 -1555 -1031 -4117 -4017 -1591 75 -644 175 526 44 -583 633 -1604 -575 989 2021 2184 1553 407 -77 3058 1081 2132 1486 198 1423 565 299 771 -254 -455 -146 -247 381 -81 -862 -541 -1651 -4301 -6197 -2885 -974 -420 -2184 900000 900000 -3049 -2106 900000 -686 12 968 -445 -1177 900000 -514 -665 -1386 963 900000 -6154 681 -2583 -3114 554 354 900000 623 419 -1588 1085 463 -5060 -399 1276 829 1820 1779 2394 315 2611 -2272 2125 2508 2063 -742 2958 3211 1670 2759 1850 3810 4615 4232 886 2064 -8116 860 2458 3997 2914 4465 3177 2046 5638 1698 2744 1954 3864 3526 2822 1684 3285 1251 -172 -206 -3219 -944 -3119 1699 2979 1261 -1354 2467 704 -1167 134 -196 1621 -44 -148 -2345 -1895 -1716 1757 -2901 -662 -4183 -731 -3517 -1563 625 -1733 -1465 -1031 -4257 -4676 -2088 109 -1025 260 830 67 -870 953 -2398 -899 1558 3059 3396 2337 598 -110 4114 1456 3055 2306 360 2858 1157 655 1803 -646 -1134 -369 -632 960 -194 -2064 -1199 -3546 SS 20250513T114118.6Z 9264.487021 207 1 54.75 2 80.36 73.69 99.48 243.88 0.00 1 0.00 1 0 17 5.504e-01 1.133e-02 4.999e-02 1.444e-03 7.556508e-01 7.653542e-04 8.573302e-03 -6.000000e+00 3.161934e-01 230.70 -2.00 3.53 -2.00 320.81 0.00e+00 2.261226e-03 3.295463e-04 1.861781e-03 -6.000000e+00 1.374485e-02 281.05 -2.00 20.00 -2.00 320.25 0.00e+00 5.695 0.003 302.00 328.00 3 1.0158e+00 2.4284e-03 6.8833e-02 -6.0000e+00 7.9161e-01 1.6234e-01 3.2310e-03 4.1697e-02 -6.0000e+00 8.5863e-01 -2.2582e-01 3.2512e-03 2.1669e-02 -6.0000e+00 5.0962e-01 8.6451e-02 1.5815e-03 6.7271e-03 -6.0000e+00 2.1504e-01 3.6122e-04 -5.0969e-04 3.6933e-05 8.7318e-05 -6.0000e+00 1.4856e-02 9.2952e-03 2.4778e-05 12 8 8 10 0 0 77.98 26.50 0.47 0.00930 0.00547 242 23 1 5 0 226.190 34.75 20.06 26.50 25.05 1.1 956.50 -209615 -216203 -193409 -199526 -189842 -189506 -110501 -68650 -169750 -178585 -111861 -160918 -106196 -79641 -84587 -84993 -23999 -40720 -42438 -49597 -32798 -6591 -69776 -28206 -44852 -43439 -31587 -34728 -28563 -24882 -22186 -20963 9741 -6025 -30312 -16050 -293 -5628 5001 1566 11831 4398 6490 -2473 2664 7132 1012 -4262 7049 10394 6096 8537 3749 5902 9051 8905 3105 3415 -4267 1856 5340 4874 6353 5895 4569 3260 3505 1689 1799 2158 2732 1473 1227 69 39 -1430 -2510 -2180 -2765 -2896 -1669 -1010 -1079 -1411 -1654 -353 -347 -114 106 142 760 -310 -414 -793 -473 -672 463 -168 -19 -709 -710 -1176 -1179 -45 -932 -878 -874 -549 -447 46 531 346 420 225 -1 376 360 5 56 69 297 602 612 281 229 536 559 893 426 233 234 101 -241 -18 -135 -443 108 47 41 -174 -218 -135 -497 -2657 -3322 -2451 -2754 -2246 -2349 -700 -329 -2510 -3094 -1087 -3173 -1600 -1200 -1692 -2023 -352 -786 -897 -1180 -665 -105 -2280 -671 -1358 -1364 -881 -968 -772 -760 -819 -918 362 -269 -1648 -789 -14 -350 346 133 1005 431 652 -277 289 761 119 -558 883 1391 970 1488 688 1160 1828 1883 713 769 -1004 407 1197 1236 1833 1923 1564 1113 1216 634 768 969 1327 745 604 32 16 -596 -1018 -931 -1271 -1601 -987 -679 -792 -1104 -1292 -289 -297 -100 92 117 578 -243 -320 -610 -417 -649 484 -204 -24 -860 -850 -1268 -1243 -48 -1009 -1001 -1057 -675 -609 67 812 562 684 357 -2 577 562 7 92 117 490 949 982 437 343 772 786 1331 692 409 432 200 -486 -39 -297 -983 242 108 92 -394 -461 -280 -1002 SS 20250513T114923.1Z 9264.492629 212 1 54.87 2 78.92 74.98 100.79 245.08 0.00 1 0.00 1 0 17 3.698e-01 9.035e-03 2.429e-02 1.035e-03 6.764185e-01 5.403779e-04 7.683536e-03 -6.000000e+00 2.124537e-01 230.70 -2.00 3.53 -2.00 320.25 0.00e+00 1.467764e-03 1.941957e-04 7.941719e-04 -6.000000e+00 9.235294e-03 281.05 -2.00 20.00 -2.00 319.65 0.00e+00 5.019 0.002 302.00 328.00 3 1.1428e+00 1.6080e-03 6.0574e-02 -6.0000e+00 5.3189e-01 9.8717e-02 2.0094e-03 3.6148e-02 -6.0000e+00 5.7692e-01 -1.3846e-01 1.8811e-03 1.8313e-02 -6.0000e+00 3.4242e-01 5.2144e-02 9.5247e-04 5.6030e-03 -6.0000e+00 1.4449e-01 6.4150e-04 -4.7523e-04 2.6817e-05 5.9857e-05 -6.0000e+00 9.9819e-03 9.2832e-03 2.5510e-05 11 8 0 10 0 0 79.04 26.52 0.42 0.00928 0.00571 288 27 1 5 0 190.480 34.50 19.91 26.52 25.38 1.1 959.03 -144415 -146311 -120820 -107782 -114479 -128836 -111296 -92327 -127645 -106300 -99244 -98752 -61317 -48919 -48264 -50021 -26916 -21458 -31389 -25307 -17115 -13476 -38480 -13321 -23308 -23816 -18047 -24325 -22838 -15426 -15439 -8387 4964 -6072 -14966 -7544 -4503 -1650 4706 1730 6882 1231 3509 -446 3892 4615 1791 266 3048 4979 3507 4724 2378 4059 3908 4330 909 1346 -877 1591 2417 3202 3717 3945 2191 979 686 146 997 952 1403 580 628 -255 -487 -1191 -2018 -1596 -2048 -1949 -1868 -1440 -1576 -1345 -1328 -505 -338 178 482 728 527 241 76 -106 -86 74 273 96 -176 -495 -414 -891 -573 -395 -880 -932 -664 -563 -319 168 501 286 258 189 97 194 253 41 187 15 95 472 465 303 187 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