File name: Pandora75s1_EssexMD_20240601_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20240602T050956.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v104d20221230.txt Level 1 file used: Pandora75s1_EssexMD_20240601_L1_smca1c1d20221230p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20240601 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-data based on session 103 First and last pixel inside fitting window: 196 337 Nominal wavelengths inside fitting window [nm]: 305.0663 305.2078 305.3493 305.4908 305.6322 305.7737 305.9151 306.0566 306.1980 306.3394 306.4807 306.6221 306.7635 306.9048 307.0461 307.1874 307.3287 307.4700 307.6112 307.7524 307.8937 308.0349 308.1761 308.3172 308.4584 308.5996 308.7407 308.8818 309.0229 309.1640 309.3051 309.4461 309.5872 309.7282 309.8692 310.0102 310.1512 310.2921 310.4331 310.5740 310.7149 310.8558 310.9967 311.1376 311.2784 311.4193 311.5601 311.7009 311.8417 311.9825 312.1233 312.2640 312.4048 312.5455 312.6862 312.8269 312.9676 313.1083 313.2489 313.3896 313.5302 313.6708 313.8114 313.9520 314.0925 314.2331 314.3736 314.5141 314.6547 314.7951 314.9356 315.0761 315.2165 315.3570 315.4974 315.6378 315.7782 315.9186 316.0590 316.1993 316.3397 316.4800 316.6203 316.7606 316.9009 317.0411 317.1814 317.3216 317.4619 317.6021 317.7423 317.8825 318.0227 318.1628 318.3030 318.4431 318.5832 318.7233 318.8634 319.0035 319.1436 319.2836 319.4237 319.5637 319.7037 319.8437 319.9837 320.1237 320.2636 320.4036 320.5435 320.6834 320.8233 320.9632 321.1031 321.2430 321.3828 321.5227 321.6625 321.8023 321.9421 322.0819 322.2217 322.3615 322.5012 322.6409 322.7807 322.9204 323.0601 323.1998 323.3395 323.4791 323.6188 323.7584 323.8980 324.0376 324.1772 324.3168 324.4564 324.5960 324.7355 324.8750 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20240601T103544.0Z 8918.441481 155 1 51.77 2 81.31 68.42 48.66 135.51 0.00 1 0.00 1 0 17 6.113e-01 1.877e-02 8.420e-02 2.777e-03 8.885334e-01 1.636985e-03 1.079385e-02 -6.000000e+00 3.774087e-01 232.17 -2.00 3.48 -2.00 321.63 0.00e+00 4.043493e-03 9.036159e-04 8.218079e-03 -6.000000e+00 1.650307e-02 286.35 -2.00 20.00 -2.00 321.12 0.00e+00 6.242 0.004 302.00 328.00 3 5.2119e-01 6.0440e-03 8.8435e-02 -6.0000e+00 9.4588e-01 5.9881e-01 8.4944e-03 7.1067e-02 -6.0000e+00 1.0166e+00 -8.6314e-01 7.9565e-03 3.4474e-02 -6.0000e+00 6.0501e-01 3.4821e-01 3.6425e-03 8.6492e-03 -6.0000e+00 2.5710e-01 2.4039e-04 -1.5556e-03 7.5339e-05 2.1654e-04 -6.0000e+00 1.8844e-02 -3.1651e-02 1.5947e-04 12 8 8 10 0 0 41.36 23.37 0.59 -0.03165 -0.04334 136 22 1 5 0 380.600 26.11 20.00 23.37 22.35 4.4 983.02 -216528 -179792 -162018 -179114 -127926 -195362 -169217 -196133 -209378 -218702 -174428 -180922 -124225 -130678 -127564 -2804 -69780 -44138 -32919 -8699 9056 -15955 -34581 -37239 -67771 -20911 -26266 -29314 -25817 -76473 -411 -47271 12442 -15619 10613 25513 -22321 17033 20333 2561 8723 21148 5044 43555 21638 36676 15834 33654 24074 13789 20315 16387 35106 33382 17643 17116 23155 18899 16786 10791 6534 6780 11530 18308 8060 12243 6427 9875 9069 14457 10551 8299 8649 1408 5373 -1296 -4256 -4280 -1298 -1365 -1304 -5362 734 -217 231 865 1011 1920 746 91 -1202 -2536 -2070 -4139 -3282 -2697 -512 -720 -754 -1516 -1741 -3463 -1921 -2240 -2135 -1858 -1497 -1103 -575 389 722 212 -16 -249 -1010 -518 179 233 973 1384 1481 2039 2295 1133 964 155 374 590 24 199 49 -265 -337 19 -24 246 566 506 53 -210 -858 -1654 -4318 -2921 -2353 -2998 -1165 -3270 -2208 -3573 -4690 -5707 -3092 -3875 -1896 -2767 -3329 -26 -1426 -771 -551 -118 103 -228 -604 -706 -1835 -402 -533 -595 -503 -2713 -8 -1843 310 -554 285 580 -876 521 721 128 463 1065 311 1863 1160 1718 939 1750 1473 1023 1584 1495 2937 3101 2045 2076 2696 2267 1982 1318 853 968 1792 3014 1580 2344 1335 2104 2166 3719 3094 2585 2630 429 1423 -331 -1068 -1126 -381 -483 -547 -2708 352 -113 127 502 611 1175 459 54 -684 -1395 -1132 -2481 -2242 -2168 -476 -707 -808 -1646 -1788 -3576 -1793 -2076 -2079 -1912 -1507 -1211 -706 541 1040 330 -25 -395 -1566 -785 274 371 1613 2327 2431 3186 3435 1653 1474 233 562 881 41 363 100 -593 -755 45 -62 616 1442 1299 134 -538 -2067 -3770 SS 20240601T104938.5Z 8918.451140 160 1 51.57 2 78.79 70.46 46.82 139.38 0.00 1 0.00 1 0 17 5.555e-01 1.422e-02 2.488e-02 1.081e-03 7.336556e-01 6.127308e-04 9.192788e-03 -6.000000e+00 3.430631e-01 232.17 -2.00 3.48 -2.00 320.76 0.00e+00 3.967641e-03 2.635639e-04 5.862425e-03 -6.000000e+00 1.499886e-02 286.35 -2.00 20.00 -2.00 320.15 0.00e+00 4.963 0.002 302.00 328.00 3 3.1654e-01 1.9589e-03 6.8436e-02 -6.0000e+00 8.5981e-01 2.1139e-01 2.5552e-03 5.1895e-02 -6.0000e+00 9.2401e-01 -3.1725e-01 2.3557e-03 2.4367e-02 -6.0000e+00 5.4992e-01 1.2575e-01 1.1485e-03 5.9979e-03 -6.0000e+00 2.3374e-01 1.1980e-03 -1.1190e-03 3.0350e-05 1.4723e-04 -6.0000e+00 1.7124e-02 -3.2457e-02 1.8777e-04 12 8 8 10 0 0 37.33 23.37 0.48 -0.03246 -0.04087 339 55 1 5 0 152.120 26.11 20.00 23.37 24.46 4.3 997.58 -195215 -187056 -173947 -163332 -174198 -187310 -173806 -176048 -167066 -162263 -156078 -142271 -118213 -109580 -88463 -55645 -55444 -54875 -38788 -34913 -31735 -39614 -33667 -41420 -34546 -29779 -35611 -33124 -37341 -37434 -22633 -18509 -8681 -8803 -12322 -9576 -10139 -4876 1154 904 5976 5758 6783 9730 8428 7250 7910 6709 6196 6377 5949 8126 9119 10256 6666 7309 5948 4685 3117 2630 3493 4520 6007 6435 4821 3851 2700 2059 3138 4687 3219 3404 2236 845 296 -1996 -3622 -4345 -3487 -2449 -1945 -2004 -1631 -1684 -776 -271 509 925 932 306 -351 -1321 -1833 -2117 -1807 -1136 -151 252 -169 -815 -1470 -2081 -1540 -1403 -1386 -1581 -995 -372 418 858 844 454 202 -230 -306 -98 367 549 787 881 964 1346 1350 1011 532 -36 97 333 110 -17 -263 -451 -409 -146 -89 129 433 332 64 -132 -652 -1017 -2880 -3064 -2750 -2331 -2603 -3086 -2614 -2985 -2881 -2907 -3109 -2804 -2292 -2529 -2107 -1167 -1344 -1480 -973 -890 -806 -1098 -912 -1301 -1085 -938 -1216 -1089 -1283 -1400 -868 -821 -405 -446 -644 -487 -564 -301 81 76 543 569 700 1007 901 803 896 802 789 878 917 1374 1686 2046 1471 1674 1417 1127 744 624 850 1195 1774 1928 1558 1262 902 725 1206 2013 1543 1700 1117 404 130 -813 -1420 -1765 -1582 -1301 -1106 -1304 -1165 -1290 -630 -215 418 776 779 248 -291 -1046 -1431 -1739 -1537 -1115 -159 300 -203 -989 -1813 -2355 -1607 -1462 -1524 -1845 -1229 -461 569 1222 1327 759 322 -381 -484 -151 567 886 1329 1435 1644 2207 2132 1542 784 -55 148 503 186 -31 -492 -909 -828 -315 -194 292 1004 777 149 -293 -1439 -2134 SS 20240601T105546.4Z 8918.455398 163 1 51.59 2 77.67 71.35 46.05 141.16 0.00 1 0.00 1 0 17 4.535e-01 1.211e-02 1.760e-02 8.056e-04 6.783258e-01 4.527093e-04 8.328220e-03 -6.000000e+00 2.800674e-01 232.17 -2.00 3.48 -2.00 320.40 0.00e+00 3.223390e-03 1.740197e-04 4.232545e-03 -6.000000e+00 1.224403e-02 286.35 -2.00 20.00 -2.00 319.77 0.00e+00 4.546 0.002 302.00 328.00 3 2.5648e-01 1.3791e-03 6.0756e-02 -6.0000e+00 7.0193e-01 1.2909e-01 1.7385e-03 4.2759e-02 -6.0000e+00 7.5432e-01 -1.9798e-01 1.5685e-03 2.0597e-02 -6.0000e+00 4.4893e-01 7.5581e-02 7.8474e-04 5.3910e-03 -6.0000e+00 1.9083e-01 2.0177e-03 -9.8893e-04 2.3076e-05 1.0642e-04 -6.0000e+00 1.3979e-02 -3.3046e-02 1.8657e-04 12 9 8 11 8 0 33.88 23.37 0.44 -0.03305 -0.04048 446 73 1 5 0 115.660 26.11 20.00 23.37 25.27 4.3 1003.16 -170465 -151984 -139379 -142471 -152897 -154755 -145918 -140385 -137944 -124142 -128976 -112920 -93853 -82579 -64066 -43590 -39804 -38503 -23362 -26909 -22328 -26993 -24867 -25072 -24859 -20976 -22868 -25457 -25680 -30009 -14791 -13622 -7344 -7149 -8109 -8013 -11187 -3569 -406 854 3642 3253 4427 5199 4536 4427 4262 3439 4041 3450 3660 5323 5148 6831 4720 4246 3670 2975 2179 1441 1904 3744 4575 4269 3619 2512 1078 1000 2269 3208 2507 2280 1774 597 -407 -1820 -3194 -3419 -3293 -2340 -1895 -1950 -1655 -1751 -489 -360 456 826 1005 493 66 -791 -1270 -1642 -1236 -819 117 338 40 -676 -1295 -1846 -1378 -1066 -1296 -1236 -824 -253 524 910 808 459 254 -190 -202 -57 387 600 696 689 719 1110 1218 874 377 -113 -39 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