File name: Pandora64s1_NewHavenCT_20210616_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20260321T232209.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20210616_L1_smca1c4d20190911p1-8.txt.bz2 Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20210616 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 20210616T095246.8Z 7837.411652 64 1 47.12 2 85.16 62.91 124.41 2.99 0.00 1 0.00 1 0 17 7.735e-01 7.257e-02 3.734e-01 3.829e-02 1.046319e+00 2.396795e-02 1.200621e-02 -6.000000e+00 4.811899e-01 232.94 -2.00 3.52 -2.00 321.79 0.00e+00 -3.576310e-02 6.845868e-03 9.414341e-03 -6.000000e+00 2.336071e-02 286.57 -2.00 20.00 -2.00 321.03 0.00e+00 10.039 0.019 302.00 328.00 3 2.4238e-01 7.3707e-02 1.4576e-01 -6.0000e+00 1.2086e+00 2.2533e+00 8.7573e-02 1.4865e-01 -6.0000e+00 1.3042e+00 -2.3437e+00 5.1683e-02 3.0889e-02 -6.0000e+00 7.7493e-01 7.9792e-01 2.7445e-02 3.4170e-02 -6.0000e+00 3.2719e-01 5.5466e-06 7.7680e-05 1.0638e-03 4.0359e-04 -6.0000e+00 2.3235e-02 6.3711e-04 6.7072e-05 12 8 8 10 0 0 30.16 21.45 0.84 0.00064 0.00122 16 4 1 5 0 2944.160 26.11 20.00 21.45 22.21 32.3 1022.27 90513 364889 10703 174940 -48270 383250 -7749 20745 103529 900000 -61516 69930 24799 190818 35073 64232 16435 900000 -11851 213298 900000 900000 181057 900000 71250 900000 6545 33723 29587 67139 -44262 151920 -19470 321221 -49357 126385 15994 70048 25425 113341 66119 5045 18975 122262 -32002 -2273 97580 3525 -24434 900000 74698 30177 53293 18146 101859 3068 43660 1262 900000 37104 4097 -3957 72983 -3502 193398 -9718 23736 35653 -6367 -4518 82012 -7153 61466 -34483 -8853 -26919 42855 4480 -2907 11398 -20182 -5033 22211 -11117 1495 -12656 36902 1297 10448 -1127 4135 16782 -8330 -17041 10170 25684 -742 7680 -2672 -14290 -7327 -6598 -11105 14329 -14526 -3072 559 -10457 2165 15356 2975 -2685 19083 7762 -2323 -2241 22 3325 -7302 5236 -3749 14950 1241 -3849 7085 3668 -12605 15678 95 190 -5137 -6019 -2930 954 458 840 1811 3957 1667 -1143 -1902 -1001 6560 13601 1308 6521 -7197 14286 -931 2191 5675 900000 -17325 5673 2979 7113 4076 5493 2162 900000 -1845 7951 900000 900000 6749 900000 5937 900000 890 2810 2206 3386 -7279 5663 -2732 11973 -8008 4711 1543 5059 3289 7393 6814 929 2788 5981 -6175 -299 4774 443 -3965 900000 5743 3937 5959 2944 8068 646 6510 252 900000 4408 659 -728 6801 -714 7209 -2088 4092 5897 -1717 -1327 11273 -2243 9594 -11870 -2186 -7149 5591 918 -745 2974 -7877 -1931 7013 -5192 652 -6577 11894 589 4169 -472 1550 5483 -3653 -9192 4883 12277 -531 5692 -2291 -13316 -5880 -4702 -7792 8137 -11689 -2304 438 -10088 2117 15219 3555 -3620 21221 9580 -3098 -2966 29 4469 -11341 7102 -5302 17636 1547 -4894 8419 4439 -17358 19697 155 355 -11361 -14633 -7519 2555 1256 2369 5120 10992 4580 -3170 -4943 -2424 SS 20210616T100456.4Z 7837.420098 67 1 48.09 2 83.11 64.82 124.27 6.40 0.00 1 0.00 1 0 17 4.318e-01 2.248e-02 1.881e-01 7.165e-03 1.008086e+00 4.410122e-03 1.125776e-02 -6.000000e+00 2.658777e-01 232.94 -2.00 3.52 -2.00 322.23 0.00e+00 9.348668e-03 2.685974e-03 1.234423e-03 -6.000000e+00 1.169970e-02 286.57 -2.00 20.00 -2.00 321.77 0.00e+00 7.623 0.008 302.00 328.00 3 4.6063e-01 1.7987e-02 9.6432e-02 -6.0000e+00 6.6786e-01 1.1786e+00 2.3753e-02 6.3518e-02 -6.0000e+00 7.1905e-01 -1.5629e+00 1.9455e-02 2.9545e-02 -6.0000e+00 4.2745e-01 6.2993e-01 8.9643e-03 1.4742e-02 -6.0000e+00 1.8036e-01 5.5334e-05 -2.4041e-03 1.9256e-04 2.2381e-04 -6.0000e+00 1.2866e-02 7.5569e-04 -8.2268e-05 12 8 8 10 0 0 -10.17 21.45 0.22 0.00076 -0.01731 76 18 1 5 0 632.390 26.11 20.00 21.45 22.28 32.4 1023.15 -81414 -73746 -29036 -141478 -128723 -135710 -142889 -155929 -104706 -85263 -134981 -129113 -31114 -95705 166402 -22214 9264 -29283 15807 -12413 -2254 -17450 900000 -10727 -12373 5157 -37079 -68768 -21379 -49938 -19838 -817 9011 18984 10736 -26856 -1968 17228 46465 30011 30041 20588 40546 30458 18234 53672 31531 26019 3089 -2774 45231 33501 26774 38615 30189 37994 26598 38310 48552 36842 12180 20141 27884 29080 30209 23445 17701 34967 11436 24001 22078 18083 7105 10328 -699 -3378 6997 -3834 -1061 7239 -3038 3627 1124 -3440 1782 613 3174 1949 2578 3043 154 -2975 -3892 -5434 -2818 -648 -2915 -284 -746 -3126 -1686 -3471 -5806 -2206 -1482 -5140 -2974 -1316 -2154 -1994 -474 -1440 14 -673 -701 -2016 1183 -385 1752 1916 1524 1792 3038 882 4437 1806 -1708 1488 1719 426 614 -947 -91 -298 857 128 -359 474 891 -666 -714 -2529 -1706 -1499 -369 -4762 -3270 -3447 -3811 -4753 -1928 -1299 -3514 -3854 -454 -3403 1162 -536 176 -874 301 -307 -47 -399 900000 -232 -267 92 -965 -2358 -475 -1744 -642 -25 286 542 307 -1126 -70 580 1357 1162 1240 967 1596 1315 892 1875 1422 1322 212 -222 2528 2319 2142 2943 2569 3040 2365 2895 3145 2644 1176 2021 2975 3472 3722 3112 2630 4685 2017 4191 4138 3537 1460 1870 -126 -622 1173 -725 -235 1791 -978 1256 433 -1470 770 280 1460 912 1178 1314 64 -1266 -1729 -2765 -1535 -413 -2235 -244 -688 -2887 -1423 -2652 -4209 -1589 -1128 -4256 -2623 -1267 -2407 -2396 -634 -2075 20 -974 -992 -2876 1697 -587 2731 2971 2266 2517 4085 1171 5991 2464 -2271 2172 2950 850 1278 -2173 -223 -792 2403 372 -994 1392 2531 -1789 -1781 -5995 SS 20210616T101549.8Z 7837.427660 70 1 48.43 2 81.25 66.50 124.03 9.44 0.00 1 0.00 1 0 25 7.964e-01 1.449e-02 9.976e-02 2.623e-03 8.697545e-01 1.555302e-03 9.921398e-03 -6.000000e+00 4.904323e-01 232.94 -2.00 3.52 -2.00 321.72 0.00e+00 4.211637e-03 8.964259e-04 4.473679e-03 -6.000000e+00 2.157588e-02 286.57 -2.00 20.00 -2.00 321.21 0.00e+00 6.206 0.004 302.00 328.00 3 5.2949e-01 5.9578e-03 8.1093e-02 -6.0000e+00 1.2319e+00 2.9108e-01 8.6836e-03 5.4997e-02 -6.0000e+00 1.3263e+00 -4.0998e-01 8.6058e-03 2.9687e-02 -6.0000e+00 7.8845e-01 1.6449e-01 3.8869e-03 9.2094e-03 -6.0000e+00 3.3256e-01 2.6370e-04 -1.1663e-03 7.2910e-05 1.6662e-04 -6.0000e+00 2.3721e-02 2.6893e-04 -7.6144e-05 12 8 8 10 0 0 -0.90 21.45 0.21 0.00027 -0.00849 185 45 1 5 0 261.750 26.11 20.00 21.45 22.61 32.2 1024.45 -272449 -252930 -244518 -260127 -273798 -215739 -251469 -232620 -223949 -204848 -262092 -184667 -179421 -140555 -123713 -108851 -113828 -74564 -65888 -80519 -87602 -54233 -55853 -56310 -52071 -50735 -75728 -73583 -50034 -66832 -42343 -17018 -13000 -22925 -14116 -30159 -10239 -12927 6255 8728 18105 5305 10966 7859 9381 7186 16359 5584 2887 4793 16249 13852 15317 17513 14886 11950 13995 8382 11089 6501 8518 10666 13610 15616 10707 7376 6455 5325 6619 5347 4875 4037 3083 1634 2210 -1461 169 -3070 -1016 51 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