File name: Pandora81s1_StocktonIL_20251104_L2Fit_fout2c2d20240325p1-8.txt File generation date: 20251105T054804.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Kevin Mishoe 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_v5d20230613.txt Instrument calibration file used: Pandora81s1_CF_v2d20240325.txt Level 1 file used: Pandora81s1_StocktonIL_20251104_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: 20251104 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 20251104T135903.2Z 9439.582676 281 1 54.74 2 77.49 124.98 112.83 316.19 0.00 1 0.00 1 0 25 2.566e-01 1.218e-02 6.575e-02 2.736e-03 4.847929e-01 1.379096e-03 5.729720e-03 -6.000000e+00 1.443042e-01 223.80 -2.00 3.53 -2.00 319.80 0.00e+00 1.877706e-03 4.198231e-04 7.047486e-04 -6.000000e+00 6.388190e-03 279.17 -2.00 20.00 -2.00 319.19 0.00e+00 4.489 0.002 302.00 328.00 3 3.5280e+00 3.9403e-03 4.9822e-02 -6.0000e+00 3.5654e-01 7.2219e-02 4.7062e-03 2.5180e-02 -6.0000e+00 3.8918e-01 -7.1234e-02 3.9443e-03 1.2810e-02 -6.0000e+00 2.3094e-01 2.6535e-02 2.0593e-03 4.0095e-03 -6.0000e+00 9.8354e-02 1.2198e-04 -8.2832e-04 7.7825e-05 4.7205e-05 -6.0000e+00 6.9927e-03 1.2687e-02 -1.8777e-06 12 8 8 10 0 0 99.98 26.47 0.35 0.01269 0.00646 60 6 1 5 0 912.180 34.75 20.00 26.47 12.32 4.4 995.03 -90162 -49619 -107007 -70507 -32816 -113042 90710 900000 -49409 -61739 92453 -50123 -12336 131968 -26228 -10462 10211 9013 25890 -17300 11503 17667 -15351 24830 -20904 -8328 181 -14849 6365 -507 13498 -2128 -2724 336 -6897 -5955 3766 -3298 282 -2507 8823 5407 12754 -6698 879 227 3552 1521 -153 4918 1591 6732 2491 76 5459 4521 120 1220 -2949 -1508 2824 4107 1446 4178 854 -1483 3799 617 1247 838 71 712 60 -2257 194 -1355 -2372 -2455 -2915 -1532 -2915 -1031 -1541 -771 -1522 614 -880 -223 -439 1078 1854 -937 -15 -702 902 415 1404 164 300 -157 -827 -1881 -1068 780 -1182 -1227 -555 -1160 -758 73 903 492 409 573 81 -187 983 -634 -431 195 414 877 661 125 -102 1362 510 700 654 608 528 44 -601 32 -418 -582 -588 221 303 -12 -461 -133 -306 -2602 -1152 -4454 -1862 -552 -4373 508 900000 -1411 -2076 691 -1805 -375 1162 -1344 -516 444 428 1098 -1177 589 858 -1106 1292 -1824 -667 13 -1189 408 -38 1016 -213 -307 37 -767 -680 444 -501 50 -534 1827 1222 2780 -1794 221 58 885 393 -41 1338 494 2170 822 27 1949 1682 47 471 -1158 -584 1104 1753 709 2166 458 -772 1836 316 708 545 46 474 40 -1429 119 -760 -1261 -1322 -1765 -1066 -2160 -840 -1354 -710 -1402 590 -899 -232 -455 1048 1656 -866 -13 -632 818 431 1644 203 393 -202 -997 -2243 -1184 880 -1473 -1495 -709 -1587 -1117 109 1451 818 667 882 117 -278 1457 -936 -677 318 673 1381 1014 185 -155 1959 714 1014 979 1002 937 77 -1100 60 -808 -1183 -1222 466 636 -24 -892 -259 -585 SS 20251104T140907.5Z 9439.589671 284 1 6.09 2 75.98 126.93 114.00 318.40 0.00 1 0.00 1 0 25 1.623e-01 1.173e-02 9.094e-02 7.048e-03 4.343966e-01 3.506440e-03 5.233801e-03 -6.000000e+00 9.075392e-02 223.80 -2.00 3.53 -2.00 319.15 0.00e+00 3.460418e-03 8.744482e-04 6.959155e-04 -6.000000e+00 4.019178e-03 279.17 -2.00 20.00 -2.00 318.52 0.00e+00 4.038 0.001 302.00 328.00 3 3.5456e+00 9.6676e-03 4.4747e-02 -6.0000e+00 2.2372e-01 6.8096e-02 1.1224e-02 2.2461e-02 -6.0000e+00 2.4405e-01 -5.6267e-02 8.4921e-03 1.1599e-02 -6.0000e+00 1.4549e-01 2.0433e-02 4.4997e-03 4.2837e-03 -6.0000e+00 6.2136e-02 1.9094e-04 -1.2970e-03 1.9886e-04 4.5095e-05 -6.0000e+00 4.3730e-03 1.4945e-02 -4.6655e-05 12 9 9 12 33 1 91.90 26.47 0.91 0.01495 0.00520 3 3 1 5 0 1520.700 34.75 20.01 26.47 12.38 4.3 993.34 -87176 -24542 -69154 -48469 4280 -64621 33098 99635 -35006 -23844 -6293 -5505 -11320 31091 8332 14104 24681 -1107 5764 -9582 7343 14927 -9931 12788 -4267 -7766 -2258 -10966 695 635 4717 6484 2828 2291 -4300 -8498 12706 -1247 183 -5312 1784 957 3297 -2026 -252 2143 2896 -961 -1778 3614 2262 1297 3143 1430 5212 2035 1078 -798 -1077 -496 1926 1224 -488 3835 431 -336 1642 -742 2014 -1596 363 2669 507 -1557 708 -898 -1544 -1752 -641 -1407 -2837 -1327 -1282 -1105 -2024 248 -928 -82 -84 582 118 -35 -2 627 904 248 652 57 279 -1135 -507 -819 -972 554 -887 -1977 -1233 -232 412 517 751 366 224 227 404 -123 1317 -685 340 652 423 952 638 -216 -1 186 253 946 494 416 230 415 -1863 762 -59 -831 -470 -220 300 50 -47 271 -656 -5033 -827 -3660 -1899 91 -2798 591 1027 -1516 -950 -216 -216 -576 1261 504 902 1527 -95 487 -981 636 1200 -1078 1178 -490 -955 -259 -1304 73 72 587 896 449 365 -689 -1466 2008 -270 43 -1517 514 293 1022 -671 -83 698 937 -326 -619 1255 872 549 1400 690 2504 950 515 -383 -507 -255 934 660 -298 2418 280 -206 960 -453 1326 -1145 276 2042 389 -1152 507 -587 -947 -1082 -435 -1029 -2400 -1233 -1182 -1072 -2131 273 -1008 -91 -92 606 122 -33 -2 574 907 265 788 73 375 -1512 -625 -985 -1101 643 -1131 -2513 -1638 -324 579 792 1165 583 349 352 583 -181 1925 -1010 529 1063 693 1514 989 -324 -1 270 353 1353 735 677 379 714 -3382 1340 -112 -1578 -911 -434 589 95 -90 492 -1175 SS 20251104T141847.2Z 9439.596379 287 1 54.76 2 74.58 128.85 115.07 320.56 0.00 1 0.00 1 0 25 4.066e-02 5.986e-03 4.342e-03 7.549e-04 4.037759e-01 3.749364e-04 4.839061e-03 -6.000000e+00 2.275521e-02 223.80 -2.00 3.53 -2.00 318.27 0.00e+00 7.807455e-04 7.122308e-05 1.584327e-04 -6.000000e+00 1.007118e-03 279.17 -2.00 20.00 -2.00 317.60 0.00e+00 3.691 0.001 302.00 328.00 3 2.1895e+00 1.0039e-03 4.0986e-02 -6.0000e+00 5.6096e-02 2.4037e-02 1.1428e-03 2.0650e-02 -6.0000e+00 6.1179e-02 -2.8851e-02 7.6591e-04 1.0251e-02 -6.0000e+00 3.6472e-02 8.5983e-03 4.0185e-04 3.0078e-03 -6.0000e+00 1.5587e-02 1.0860e-03 -4.4478e-04 2.1081e-05 3.2215e-05 -6.0000e+00 1.0955e-03 1.1495e-02 1.3873e-05 10 0 0 10 0 0 99.87 26.48 0.33 0.01150 0.00815 223 21 1 5 0 245.520 34.75 20.01 26.48 12.06 4.4 992.14 -16386 -10319 -15539 -15548 -14948 -22350 -4834 523 -10635 -12907 -7802 -12562 -4496 3515 -3159 -1250 335 1123 2050 -608 1240 1376 -674 1869 -1596 -973 -948 -1986 -2061 -184 858 1063 912 -1809 -3001 -2770 -1796 -778 113 -38 321 251 587 -360 -5 153 216 -374 79 1015 980 1170 1034 1428 1804 1410 483 661 159 212 1011 1519 1824 1440 580 -6 28 14 681 498 537 105 -40 -489 -218 -579 -1022 -1075 -1056 -1001 -1183 -1649 -1893 -1455 -1041 -609 -496 -44 209 507 668 366 391 557 389 296 615 388 -44 -271 -444 -700 -398 -225 -793 -806 -724 -473 -33 164 495 215 248 81 60 303 317 195 38 -18 -61 94 315 414 368 447 642 840 460 421 220 28 -189 95 -125 -313 -36 42 -137 -255 -279 -251 -342 -896 -575 -913 -830 -733 -1216 -246 29 -719 -923 -542 -1033 -409 353 -361 -155 44 155 295 -93 187 209 -111 324 -303 -191 -182 -363 -366 -34 178 246 233 -434 -748 -713 -477 -245 39 -15 140 107 257 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