File name: Pandora64s1_NewHavenCT_20230919_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240123T145741.8Z 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 v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20230919_L1_smca1c4d20190911p1-8.txt 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: 20230919 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 20230919T111753.8Z 8662.470761 59 1 48.12 2 82.95 94.25 131.02 78.68 0.00 1 0.00 1 0 25 5.273e-01 3.750e-02 1.481e-01 8.062e-03 8.468719e-01 4.716141e-03 1.251231e-02 -6.000000e+00 3.199339e-01 228.81 -2.00 3.52 -2.00 321.86 0.00e+00 4.734649e-02 2.401472e-03 3.854190e-03 -6.000000e+00 1.432393e-02 287.20 -2.00 20.00 -2.00 321.34 0.00e+00 7.474 0.008 302.00 328.00 3 8.2764e-01 1.7138e-02 9.0052e-02 -6.0000e+00 7.9534e-01 1.4835e+00 1.9975e-02 7.4061e-02 -6.0000e+00 8.5869e-01 -1.8508e+00 1.2436e-02 2.5736e-02 -6.0000e+00 5.1247e-01 7.5331e-01 6.5632e-03 3.7435e-02 -6.0000e+00 2.1825e-01 4.2941e-05 -4.1973e-03 2.1610e-04 7.0629e-04 -6.0000e+00 1.5689e-02 -2.0433e-03 -8.1971e-05 12 8 8 10 0 0 26.86 21.65 0.18 -0.00204 -0.03358 48 12 1 5 0 1002.330 26.11 19.99 21.65 21.68 38.0 1002.31 135016 174423 150577 128437 -108829 101264 474 -41531 30177 12150 -41275 -7763 27359 33963 63019 94184 105719 158987 76994 143867 81543 166034 87251 115504 14803 46683 -12161 3834 23597 -32678 49227 116208 67819 107586 77302 54892 75393 58863 47278 43188 56387 62029 73716 36808 58091 65023 78457 72108 58244 21069 73020 73221 61791 34967 49642 26983 25067 1366 30807 20266 36129 17680 33859 36729 49711 24062 35145 31763 21914 18899 13350 10422 9678 -4447 116 -8217 14670 -7535 -2867 626 313 -11501 1239 -4142 -5160 -4102 -841 -3143 998 -37 -3854 -4344 -11290 -9827 -8157 -5471 -2976 -225 676 185 1342 -2006 -5791 -3069 -4823 -6015 -4269 -587 -3630 -1607 -851 -1406 -2062 -191 -1119 -1750 706 723 1737 3388 3016 2996 3708 4397 4113 2880 -854 1936 1915 1397 1691 414 -17 234 -29 -477 -742 -506 433 -589 -1176 -2377 3570 3365 3658 3304 -19938 2098 21 -2013 647 269 -1475 -244 880 1456 2657 3500 3853 3635 3961 3598 3380 2492 2432 1981 582 1201 -539 148 843 -2569 2251 3239 3441 3613 3093 2589 2909 2776 2635 2623 3062 3280 3687 2788 3736 4135 4597 4792 4661 2374 5792 6174 6049 4192 5392 3490 3135 187 3324 2505 4157 2571 4835 5774 7164 4413 5870 5638 4694 4618 3577 2854 2504 -1203 27 -1873 2643 -1851 -809 207 121 -5230 532 -1959 -2605 -2138 -440 -1705 515 -18 -1866 -2028 -5652 -5318 -5125 -4019 -2525 -216 690 187 1247 -1716 -4723 -2477 -4229 -5597 -4238 -619 -4170 -2074 -1220 -2142 -3190 -285 -1630 -2542 1041 1123 2816 5471 4726 4472 5322 6046 5512 3838 -1179 2884 3326 2772 3472 925 -41 595 -79 -1263 -1983 -1363 1207 -1561 -2928 -5610 SS 20230919T112843.4Z 8662.478280 62 1 48.33 2 80.93 96.06 129.12 80.73 0.00 1 0.00 1 0 25 4.842e-01 1.906e-02 8.009e-02 2.681e-03 7.312805e-01 1.523597e-03 9.268329e-03 -6.000000e+00 2.938561e-01 228.81 -2.00 3.52 -2.00 321.29 0.00e+00 1.121718e-02 7.768399e-04 5.852343e-03 -6.000000e+00 1.315503e-02 287.20 -2.00 20.00 -2.00 320.71 0.00e+00 6.008 0.004 302.00 328.00 3 9.6298e-01 5.3365e-03 7.4867e-02 -6.0000e+00 7.3051e-01 3.1125e-01 7.1299e-03 4.6883e-02 -6.0000e+00 7.8862e-01 -4.2797e-01 6.5459e-03 2.7167e-02 -6.0000e+00 4.7066e-01 1.7485e-01 3.0998e-03 1.0436e-02 -6.0000e+00 2.0051e-01 2.3463e-04 -1.3584e-03 7.6112e-05 2.1504e-04 -6.0000e+00 1.4407e-02 -2.7550e-03 -4.1740e-05 12 8 8 10 0 0 45.97 21.63 0.12 -0.00276 -0.01296 134 32 1 5 0 360.620 26.11 20.00 21.63 22.17 37.8 1004.19 -180717 -102572 -137915 -112632 -292270 -123743 -147941 -156791 -146842 -121593 -146032 -80154 -89590 -75880 -42034 -14892 -26037 802 -28083 20512 -35231 18580 18912 47 -25520 -10845 -36523 -15132 -27165 -28717 13265 -161 21896 21169 10700 3365 12470 12934 14117 4931 16080 14238 18889 11579 19453 13882 22520 17111 15052 3524 18081 14948 17379 9966 17248 8179 10583 4946 11033 6292 9643 7631 11453 9867 12814 4955 7886 4652 6569 4810 4518 2658 2412 1500 193 -2498 1954 -3610 -724 1527 -357 -2661 -2144 -2658 -1829 -1882 -431 -671 688 -192 -1586 -1330 -3059 -2448 -1958 -1242 -1675 821 -78 -934 -577 -1858 -3339 -789 -727 -2290 -1284 -681 -727 56 426 430 -196 137 -213 -305 800 407 814 1137 515 864 1371 1442 1662 1132 -858 903 1134 688 558 -274 -532 -409 493 -44 -775 178 407 -328 -359 -1240 -3006 -965 -1947 -1148 -15072 -1294 -2050 -2541 -2303 -1557 -2558 -901 -1475 -1428 -714 -230 -504 13 -653 306 -912 277 292 1 -654 -247 -1079 -360 -774 -976 368 -6 750 747 400 129 489 593 762 335 1066 1025 1374 930 1493 1171 1814 1545 1477 425 2123 2000 2260 1504 2502 1336 1704 826 1702 1035 1645 1499 2465 2407 3118 1289 2058 1322 2074 1743 1744 981 929 543 64 -785 581 -1217 -278 630 -174 -1502 -1296 -1715 -1256 -1362 -320 -506 506 -136 -1065 -858 -2007 -1738 -1597 -1088 -1699 920 -92 -1090 -625 -1839 -3173 -763 -750 -2511 -1504 -803 -959 82 641 671 -306 220 -329 -466 1249 625 1313 1849 819 1401 2152 2174 2429 1621 -1250 1423 1906 1294 1082 -568 -1178 -964 1162 -107 -1934 444 995 -765 -838 -2774 SS 20230919T113942.2Z 8662.485905 67 1 48.35 2 78.88 97.92 127.19 82.74 0.00 1 0.00 1 0 25 3.604e-01 8.961e-03 3.947e-02 1.268e-03 6.283898e-01 7.095922e-04 7.274956e-03 -6.000000e+00 2.187280e-01 228.81 -2.00 3.52 -2.00 320.66 0.00e+00 2.094276e-03 3.009379e-04 8.739527e-04 -6.000000e+00 9.791378e-03 287.20 -2.00 20.00 -2.00 320.01 0.00e+00 5.000 0.002 302.00 328.00 3 8.3355e-01 2.2763e-03 6.0093e-02 -6.0000e+00 5.4375e-01 2.6994e-02 2.9487e-03 3.3827e-02 -6.0000e+00 5.8698e-01 -4.0838e-02 2.7103e-03 1.7505e-02 -6.0000e+00 3.5031e-01 9.7321e-03 1.3281e-03 5.6743e-03 -6.0000e+00 1.4926e-01 8.1823e-04 -8.0085e-04 3.7623e-05 7.4155e-05 -6.0000e+00 1.0722e-02 -3.2201e-03 -2.9303e-05 11 8 0 10 0 0 40.12 21.63 0.23 -0.00322 -0.00924 275 66 1 5 0 175.780 26.11 20.00 21.63 22.75 38.1 1007.73 -119661 -115735 -101817 -132042 -208271 -123704 -100663 -118657 -65491 -97871 -72782 -83313 -44681 -52250 -19860 -37457 -9603 -29279 -15845 -21922 -13978 -17440 4732 -20767 -1595 -17919 -8895 -19386 -7081 -19183 746 -9260 4475 -5658 -3070 -7256 1499 -3412 5904 1648 3526 2363 4331 782 3885 3651 3426 2811 2536 884 3537 448 2653 2578 1039 1829 978 1136 482 1041 856 1977 2345 3918 1991 300 364 97 1600 2052 176 1275 -507 719 -779 -736 -1222 -1479 -1378 -207 -1902 -960 -2106 -1853 -833 -565 201 502 1173 1117 302 478 -907 69 262 260 -354 1139 525 -319 -426 -1763 -2201 -331 474 -1514 -570 -769 -287 232 868 243 344 63 -191 -368 478 -255 697 198 -71 -385 730 329 1010 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