File name: Pandora107s1_LynnMA_20240504_L2Fit_fout2c7d20230718p1-8.txt File generation date: 20240916T084026.6Z 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_20240504_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: 20240504 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 20240504T101935.5Z 8890.430272 107 1 30.46 2 82.93 74.51 64.84 124.08 0.00 1 0.00 1 0 17 4.494e-01 2.700e-02 4.362e-01 2.052e-02 1.009017e+00 1.252030e-02 1.119764e-02 -6.000000e+00 2.703014e-01 230.13 -2.00 3.54 -2.00 322.31 0.00e+00 -5.976377e-03 6.928548e-03 5.056292e-03 -6.000000e+00 1.241305e-02 281.25 -2.00 20.00 -2.00 321.85 0.00e+00 7.468 0.008 302.00 328.00 3 1.5235e+00 4.9279e-02 9.9671e-02 -6.0000e+00 6.7591e-01 1.3808e+00 6.2934e-02 7.4523e-02 -6.0000e+00 7.3058e-01 -1.8307e+00 4.8546e-02 3.2639e-02 -6.0000e+00 4.3383e-01 7.2751e-01 2.3115e-02 1.0307e-02 -6.0000e+00 1.8253e-01 2.2825e-05 -1.9766e-03 5.6418e-04 1.3698e-04 -6.0000e+00 1.3269e-02 -3.4745e-02 0.0000e+00 12 8 8 10 0 0 7.49 21.04 0.59 -0.03475 -0.04960 20 20 1 5 0 1522.700 25.28 20.00 21.04 15.97 0.0 908.12 253872 5234 -17298 -21681 3626 23805 -58750 -108796 -53767 -22736 900000 2428 83151 -115329 20981 95259 14179 93486 71602 105357 -22932 5246 -48912 29874 114052 7525 -12746 -95533 -18601 10275 5409 68584 3970 -25349 95819 4958 -5968 -25553 78615 -22929 40053 28056 98686 17225 -8643 110219 16623 44215 90896 63737 24381 88024 98349 56137 30798 37747 57535 43647 35917 58015 26203 14057 32949 32776 9101 22117 61451 29869 22252 24842 21316 16244 9981 15210 8468 12257 -7238 -6127 4457 -10951 10949 -12373 10238 -9781 8790 -508 7569 1511 -1497 9528 -5114 1241 -10424 -4510 -5032 -1816 210 -2489 -1292 -2730 -5412 490 -5046 -198 -4895 -2800 -3143 -1807 -3237 -273 -1799 -522 -409 -2903 -1377 3722 2354 2211 1109 204 276 2013 2650 2564 1208 -1149 2170 2106 4328 -98 -1108 618 -943 -480 219 427 158 865 -584 -1205 450 -806 -376 5080 124 -504 -592 73 476 -1603 -5146 -1565 -496 900000 49 1664 -9022 496 1906 439 1871 1433 2108 -1001 162 -2492 777 2282 271 -536 -7647 -707 288 173 1372 175 -1573 1918 208 -275 -1585 2045 -1927 2004 1684 2962 1138 -709 2647 998 2035 2728 2679 1659 3523 3936 3707 2773 3324 4260 3668 3091 3715 2202 1378 2967 3345 1293 2877 5411 3706 3295 4076 4010 3381 2197 2983 1593 1962 -1289 -1079 785 -2674 2585 -4333 3237 -4130 3272 -217 3135 686 -698 3832 -2262 489 -4506 -1922 -2447 -1017 137 -1775 -1027 -2345 -4657 358 -3817 -136 -3615 -2157 -2585 -1569 -2897 -276 -2141 -687 -574 -4246 -1951 4889 3126 3037 1622 312 419 2853 3519 3293 1545 -1461 2598 2609 5953 -167 -2201 1334 -2238 -1228 601 1241 474 2603 -1766 -3555 1219 -2007 -871 SS 20240504T103043.8Z 8890.438007 110 1 30.48 2 80.94 76.32 63.16 126.44 0.00 1 0.00 1 0 25 6.869e-01 1.504e-02 3.825e-01 8.252e-03 8.640782e-01 4.761994e-03 1.026783e-02 -6.000000e+00 4.151121e-01 230.13 -2.00 3.54 -2.00 321.85 0.00e+00 1.530516e-02 2.711412e-03 4.106633e-03 -6.000000e+00 1.824890e-02 281.26 -2.00 20.00 -2.00 321.39 0.00e+00 6.024 0.004 302.00 328.00 3 1.8726e+00 1.8031e-02 7.7664e-02 -6.0000e+00 1.0395e+00 4.9270e-01 2.6841e-02 5.0465e-02 -6.0000e+00 1.1239e+00 -5.9671e-01 2.8438e-02 3.3706e-02 -6.0000e+00 6.6546e-01 2.3345e-01 1.2936e-02 1.8837e-02 -6.0000e+00 2.7858e-01 7.6291e-05 -8.7565e-04 2.2665e-04 3.0711e-04 -6.0000e+00 2.0386e-02 -3.6091e-02 0.0000e+00 12 8 8 10 0 0 51.05 21.08 0.82 -0.03609 -0.04267 32 32 1 5 0 952.280 25.39 20.01 21.08 16.79 0.0 911.53 -249648 -238232 -81273 -204811 -209521 -271946 -262843 -174143 900000 54508 -171510 -237096 -122487 -109424 -94559 -131030 66837 -69654 -60121 -53682 -75950 236745 55500 -13192 -17450 -58171 -81261 -42186 -10326 107 35892 -4000 -25254 -8695 24340 42283 -3887 45647 63618 29121 -10227 -2701 17670 -4300 9383 1828 3734 31551 31787 13421 1531 16766 11367 7845 14320 12821 28802 3734 4892 -2809 3188 -10416 4563 14349 4127 14530 13496 13468 12368 12299 5185 2635 4255 -3421 -5705 -6596 -3860 620 745 806 3828 382 -686 -2244 219 2471 1488 409 367 810 -3239 85 -1534 -2493 -601 -1728 908 -741 -1611 -1917 -511 -723 1273 -42 -2291 -3070 -2004 -137 -279 -414 -978 -1166 37 -955 614 1516 2102 1803 1176 -1593 -593 1843 1031 475 -512 -544 1153 1656 1790 254 -629 -186 778 -295 187 -1020 -73 529 -376 -796 -85 335 278 -2739 -2962 -654 -2097 -2145 -4774 -4037 -1401 900000 439 -1380 -3815 -985 -968 -989 -2530 538 -1009 -871 -777 -1405 1905 447 -127 -183 -936 -1635 -577 -108 1 318 -68 -650 -210 431 612 -91 735 1024 773 -453 -122 697 -221 438 96 201 1371 1483 821 117 1241 997 776 1406 1331 2595 430 543 -330 359 -1467 635 2090 740 2467 2324 2373 2428 2751 1385 763 1212 -999 -1556 -1635 -863 134 180 233 1294 156 -318 -1042 105 1224 786 227 204 436 -1732 46 -806 -1360 -328 -1127 685 -661 -1631 -2058 -524 -668 1030 -33 -1898 -2728 -1871 -134 -302 -514 -1390 -1822 60 -1553 951 2252 3088 2749 1904 -2521 -1011 2937 1569 701 -745 -765 1544 2267 2747 461 -1202 -386 1707 -703 475 -2772 -188 1363 -973 -2183 -217 786 616 SS 20240504T104222.2Z 8890.446090 115 1 30.80 2 78.85 78.20 61.46 128.99 0.00 1 0.00 1 0 25 4.152e-01 2.127e-02 2.913e-01 1.126e-02 7.284559e-01 6.332265e-03 9.671015e-03 -6.000000e+00 2.498289e-01 230.13 -2.00 3.54 -2.00 321.35 0.00e+00 1.592668e-02 2.996523e-03 6.411651e-03 -6.000000e+00 1.096916e-02 281.26 -2.00 20.00 -2.00 320.83 0.00e+00 4.990 0.002 302.00 328.00 3 3.5146e+00 2.1371e-02 6.6754e-02 -6.0000e+00 6.2429e-01 5.3603e-01 2.7511e-02 4.4804e-02 -6.0000e+00 6.7447e-01 -6.6641e-01 2.4643e-02 3.0568e-02 -6.0000e+00 4.0093e-01 2.6766e-01 1.1843e-02 1.5490e-02 -6.0000e+00 1.6845e-01 4.3668e-05 -1.0046e-03 3.2209e-04 2.7768e-04 -6.0000e+00 1.2216e-02 -3.7420e-02 0.0000e+00 12 8 8 10 0 0 97.08 21.11 0.48 -0.03742 -0.04497 12 12 1 5 0 2565.790 25.39 20.01 21.11 17.36 0.0 913.22 7410 -184287 -44258 -157093 -104486 -4681 -151118 -85746 -134733 24074 -147297 -101373 -136494 -79944 58918 -52729 34132 -19825 -12491 1063 -28680 104622 -39141 3844 28801 -46912 -46904 -65263 21177 1093 -18855 -6537 -8833 42109 1303 78582 -10773 82121 45361 23841 11414 5604 36001 8363 33143 13555 14745 3737 5026 22233 4838 13411 19121 8713 16383 18196 13890 11034 22947 8328 578 17957 -919 27854 -72 14951 -721 14973 12838 1999 10048 3618 6266 -3831 2535 -718 -3269 4431 -1914 1232 2689 15 -977 -2526 3007 -5668 -365 -3630 -3323 -3822 -2661 -939 -1137 376 1717 -2688 439 -1969 504 -3189 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