File name: Pandora107s1_LynnMA_20240706_L2Fit_fout2c7d20230718p1-8.txt File generation date: 20240916T090035.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c7p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 107 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora107_OF_v1d20230601.txt Instrument calibration file used: Pandora107s1_CF_v7d20230718.txt Level 1 file used: Pandora107s1_LynnMA_20240706_L1_smca1c7d20230718p1-8.txt Full location name: Lynn Massachusetts Department of Environmental Protection Short location name: LynnMA Country of location: United States Location latitude [deg]: 42.4746 Location longitude [deg]: -70.9708 Location altitude [m]: 52 Local noon date: 20240706 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: OOB session based on clearance session 6 First and last pixel inside fitting window: 220 362 Nominal wavelengths inside fitting window [nm]: 305.0382 305.1791 305.3200 305.4608 305.6017 305.7426 305.8834 306.0242 306.1650 306.3059 306.4467 306.5874 306.7282 306.8690 307.0097 307.1505 307.2912 307.4319 307.5727 307.7134 307.8540 307.9947 308.1354 308.2761 308.4167 308.5573 308.6980 308.8386 308.9792 309.1198 309.2604 309.4009 309.5415 309.6820 309.8226 309.9631 310.1036 310.2441 310.3846 310.5251 310.6656 310.8060 310.9465 311.0869 311.2273 311.3678 311.5082 311.6485 311.7889 311.9293 312.0697 312.2100 312.3504 312.4907 312.6310 312.7713 312.9116 313.0519 313.1922 313.3324 313.4727 313.6129 313.7531 313.8934 314.0336 314.1738 314.3139 314.4541 314.5943 314.7344 314.8746 315.0147 315.1548 315.2949 315.4350 315.5751 315.7152 315.8552 315.9953 316.1353 316.2754 316.4154 316.5554 316.6954 316.8354 316.9753 317.1153 317.2552 317.3952 317.5351 317.6750 317.8149 317.9548 318.0947 318.2346 318.3744 318.5143 318.6541 318.7939 318.9338 319.0736 319.2134 319.3531 319.4929 319.6327 319.7724 319.9121 320.0519 320.1916 320.3313 320.4710 320.6107 320.7503 320.8900 321.0296 321.1693 321.3089 321.4485 321.5881 321.7277 321.8673 322.0068 322.1464 322.2859 322.4255 322.5650 322.7045 322.8440 322.9835 323.1230 323.2624 323.4019 323.5413 323.6808 323.8202 323.9596 324.0990 324.2384 324.3777 324.5171 324.6564 324.7958 324.9351 --------------------------------------------------------------------------------------- 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 20240706T145112.9Z 8953.618899 253 1 1.60 2 31.50 119.83 36.06 104.43 0.00 1 0.00 1 0 17 1.327e-02 1.105e-02 1.692e-03 1.275e-03 1.674923e-01 6.938144e-04 2.052346e-03 -6.000000e+00 8.066075e-03 233.00 -2.00 3.54 -2.00 314.39 0.00e+00 2.417372e-05 5.391719e-05 2.140301e-05 -6.000000e+00 3.599964e-04 287.57 -2.00 20.00 -2.00 313.78 0.00e+00 1.172 0.000 302.00 328.00 3 1.8899e+00 1.7866e-03 1.4744e-02 -6.0000e+00 2.0256e-02 2.4521e-02 1.9660e-03 8.8411e-03 -6.0000e+00 2.1817e-02 -8.8485e-03 1.1260e-03 4.2912e-03 -6.0000e+00 1.2987e-02 6.1330e-04 4.8181e-04 1.1749e-03 -6.0000e+00 5.4555e-03 2.1111e-02 1.3433e-04 3.8360e-05 1.7180e-05 -6.0000e+00 3.9092e-04 -3.3104e-02 0.0000e+00 12 9 9 12 1 1 98.93 22.51 0.35 -0.03310 -0.03209 16 321 1 5 0 93.480 26.62 20.01 22.51 30.95 0.0 967.87 37 -2540 -3084 -3799 -933 1888 1985 1607 -682 -2049 -1407 2000 1936 1034 -120 -829 -203 1317 828 925 -239 929 2098 1923 1153 -46 -1057 -1204 1193 2265 2648 1936 462 -2572 -2546 670 1499 1109 519 -2019 -2384 -1768 -996 -1373 -727 -785 -733 -519 -353 1115 1535 938 870 595 79 965 756 500 688 1345 1863 1940 691 -268 -2215 -1078 706 1773 3051 770 -723 -786 -1099 -889 -831 -452 270 1277 1975 394 -1170 -1898 -2305 -1221 -323 -487 -354 -529 -315 -518 -33 139 1390 2770 2232 794 675 -190 -1382 -1829 -1240 -576 1051 1189 -914 -1706 -857 -684 100 397 198 -625 -274 121 964 1856 2089 1530 1123 -327 -770 -725 -166 -10 548 239 1075 1944 1029 -38 -757 -553 35 344 154 -634 15 87 -619 -661 -304 -334 217 14 -1072 -1336 -1580 -373 672 697 621 -281 -899 -612 840 847 473 -62 -438 -111 726 467 536 -135 523 1229 1085 692 -29 -667 -726 702 1244 1426 1102 269 -1569 -1514 394 892 713 360 -1574 -1959 -1467 -844 -1174 -618 -662 -633 -432 -282 903 1257 774 761 519 70 878 699 464 630 1214 1699 1782 660 -272 -2222 -1057 671 1554 2717 740 -743 -821 -1167 -925 -854 -442 246 1105 1686 352 -1133 -1951 -2447 -1352 -362 -562 -421 -656 -392 -631 -39 156 1502 2769 2270 845 758 -226 -1716 -2323 -1495 -680 1204 1331 -1070 -2077 -1089 -869 131 528 275 -861 -379 161 1201 2204 2495 1817 1424 -420 -1043 -990 -221 -13 688 296 1295 2261 1244 -47 -970 -721 46 448 211 -890 21 125 -904 -962 -431 -469 297 SS 20240706T150148.7Z 8953.626258 256 1 30.95 2 29.83 123.34 34.23 106.92 0.00 1 0.00 1 0 17 1.209e-02 9.500e-03 3.366e-03 2.170e-03 1.685785e-01 1.167874e-03 2.047098e-03 -6.000000e+00 7.345023e-03 233.00 -2.00 3.54 -2.00 315.16 0.00e+00 1.446138e-04 1.051996e-04 5.838090e-05 -6.000000e+00 3.278278e-04 287.57 -2.00 20.00 -2.00 314.47 0.00e+00 1.152 0.000 302.00 328.00 3 5.6910e+00 3.0304e-03 1.4617e-02 -6.0000e+00 1.8445e-02 4.6928e-02 3.3484e-03 8.8745e-03 -6.0000e+00 1.9867e-02 -7.8057e-03 1.9098e-03 4.2983e-03 -6.0000e+00 1.1826e-02 -1.6673e-03 8.3476e-04 1.1741e-03 -6.0000e+00 4.9676e-03 4.7549e-04 1.6088e-04 6.5776e-05 1.6290e-05 -6.0000e+00 3.5600e-04 -3.2835e-02 0.0000e+00 12 8 8 10 0 0 99.97 22.57 0.40 -0.03283 -0.03163 9 9 1 5 0 3437.700 26.62 20.00 22.57 32.58 0.0 973.82 -179 -1764 -3646 -4045 725 1625 1041 1381 641 -2160 -1678 2602 933 692 -437 -805 -298 629 251 1376 1196 561 1849 1760 967 -454 -1108 -1449 364 2286 2113 100 1019 -3523 -1463 454 221 951 98 -1439 -1668 -763 -940 -1270 -410 -69 -928 -439 -76 451 2033 121 1021 1196 378 978 631 124 963 1631 1681 2063 860 -227 -1790 -834 918 1187 2970 1173 -389 -959 -1268 -541 -276 -428 60 619 1624 -353 -697 -2196 -2670 -597 -301 -167 -358 -270 -621 -505 -206 231 1050 1995 1885 956 263 -7 -1223 -1629 -809 -666 889 1130 -718 -1552 -1012 -823 303 718 116 -312 -249 128 636 1492 1735 966 832 -146 -325 -224 69 2 819 67 774 1381 628 54 -704 -439 315 389 78 -463 -203 72 -332 -640 -314 -517 289 -52 -566 -1210 -1292 209 430 275 393 203 -729 -565 845 319 258 -181 -356 -136 289 118 658 581 276 898 866 501 -245 -598 -757 179 1061 972 49 519 -1886 -757 224 112 529 62 -1031 -1284 -609 -769 -1048 -336 -56 -749 -345 -58 339 1534 96 835 1005 325 852 557 111 842 1412 1469 1870 823 -226 -1815 -811 828 1019 2576 1096 -392 -1007 -1348 -565 -278 -410 53 515 1336 -310 -660 -2239 -2856 -654 -342 -197 -442 -342 -790 -631 -249 264 1114 2014 1919 1028 301 -9 -1559 -2105 -1010 -789 1007 1290 -864 -1959 -1313 -1091 410 1000 166 -454 -356 176 823 1831 2092 1188 1066 -196 -451 -312 94 3 1063 85 941 1648 767 68 -929 -585 421 530 110 -673 -302 108 -504 -972 -469 -756 415 SS 20240706T155841.0Z 8953.665752 287 1 30.02 2 22.47 148.37 25.04 124.17 0.00 1 0.00 1 0 17 1.346e-02 1.038e-02 1.330e-03 8.717e-04 1.567235e-01 4.704390e-04 1.911665e-03 -6.000000e+00 8.181170e-03 233.00 -2.00 3.54 -2.00 315.09 0.00e+00 -4.070501e-05 4.151765e-05 4.377320e-05 -6.000000e+00 3.651288e-04 287.57 -2.00 20.00 -2.00 314.41 0.00e+00 1.082 0.000 302.00 328.00 3 3.8982e+00 1.2200e-03 1.3684e-02 -6.0000e+00 2.0545e-02 2.9474e-02 1.3473e-03 8.2702e-03 -6.0000e+00 2.2129e-02 -7.2358e-03 7.6770e-04 4.0074e-03 -6.0000e+00 1.3172e-02 -8.5923e-04 3.3447e-04 1.1007e-03 -6.0000e+00 5.5335e-03 3.1617e-03 2.4707e-04 2.6475e-05 1.5389e-05 -6.0000e+00 3.9647e-04 -3.3323e-02 0.0000e+00 12 8 8 10 0 0 99.99 22.72 0.42 -0.03332 -0.03147 160 160 1 5 0 187.540 26.73 20.00 22.72 33.35 0.0 974.71 157 -2940 -3451 -4563 -1134 1354 2850 2115 -646 -2174 -1885 1747 1750 1264 233 -999 -469 691 725 1264 191 1046 2326 2102 1198 -111 -1622 -1469 1136 2050 2511 1375 988 -3150 -2192 687 1392 1246 64 -1604 -2141 -1350 -914 -1217 -268 -690 -975 -682 -281 1175 1670 916 929 731 394 1179 600 508 898 1512 2057 1988 921 -348 -1901 -1239 434 1687 2897 725 -735 -1269 -1046 -734 -811 -390 423 1030 1944 478 -1009 -1577 -2115 -937 -296 -410 -448 -502 -285 -572 -162 280 1100 2491 1911 961 455 -118 -1342 -1783 -1172 -375 1212 1304 -902 -1661 -964 -667 300 643 130 -571 -150 241 909 1785 1993 1358 979 -360 -758 -543 -176 74 550 172 891 1904 977 -213 -614 -735 87 358 68 -502 -102 26 -414 -404 -390 -331 293 46 -976 -1173 -1492 -330 387 792 648 -206 -741 -638 568 591 473 98 -457 -221 330 352 626 98 533 1163 1071 650 -64 -929 -800 568 957 1145 664 510 -1716 -1152 338 694 709 40 -1177 -1603 -1064 -737 -989 -216 -553 -766 -558 -220 888 1272 737 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