File name: Pandora55s1_QueensNY_20210210_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T175359.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c11p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v11d20210101.txt Level 1 file used: Pandora55s1_QueensNY_20210210_L1_smca1c11d20210101p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20210210 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: None First and last pixel inside fitting window: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0145 305.1546 305.2946 305.4346 305.5746 305.7145 305.8545 305.9945 306.1344 306.2744 306.4143 306.5542 306.6941 306.8340 306.9739 307.1138 307.2536 307.3935 307.5333 307.6732 307.8130 307.9528 308.0926 308.2324 308.3722 308.5120 308.6517 308.7915 308.9312 309.0710 309.2107 309.3504 309.4901 309.6298 309.7695 309.9091 310.0488 310.1884 310.3281 310.4677 310.6073 310.7469 310.8865 311.0261 311.1657 311.3053 311.4448 311.5844 311.7239 311.8634 312.0029 312.1424 312.2819 312.4214 312.5609 312.7003 312.8398 312.9792 313.1187 313.2581 313.3975 313.5369 313.6763 313.8156 313.9550 314.0944 314.2337 314.3730 314.5124 314.6517 314.7910 314.9303 315.0695 315.2088 315.3481 315.4873 315.6265 315.7658 315.9050 316.0442 316.1834 316.3226 316.4617 316.6009 316.7401 316.8792 317.0183 317.1574 317.2966 317.4357 317.5747 317.7138 317.8529 317.9919 318.1310 318.2700 318.4090 318.5481 318.6871 318.8260 318.9650 319.1040 319.2429 319.3819 319.5208 319.6598 319.7987 319.9376 320.0765 320.2153 320.3542 320.4931 320.6319 320.7708 320.9096 321.0484 321.1872 321.3260 321.4648 321.6036 321.7423 321.8811 322.0198 322.1586 322.2973 322.4360 322.5747 322.7134 322.8520 322.9907 323.1294 323.2680 323.4066 323.5453 323.6839 323.8225 323.9611 324.0996 324.2382 324.3768 324.5153 324.6538 324.7924 324.9309 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20210210T135156.7Z 7711.577740 103 1 49.48 2 71.42 129.05 71.97 145.38 0.00 1 0.00 1 0 25 6.998e-01 7.663e-02 5.748e-02 3.676e-03 3.949734e-01 1.879275e-03 4.745325e-03 -6.000000e+00 4.104676e-01 224.71 -2.00 3.51 -2.00 318.87 0.00e+00 4.466280e-02 4.180085e-04 7.267771e-04 -6.000000e+00 1.802418e-02 275.26 -2.00 20.00 -2.00 318.35 0.00e+00 3.100 0.000 302.00 328.00 3 4.4576e+00 5.0849e-03 4.5591e-02 -6.0000e+00 1.0143e+00 4.7172e-01 5.6975e-03 6.1613e-02 -6.0000e+00 1.1026e+00 -6.8676e-01 3.5618e-03 2.0903e-02 -6.0000e+00 6.5658e-01 3.5298e-01 1.8753e-03 3.6455e-02 -6.0000e+00 2.7683e-01 1.4008e-04 -1.0376e-03 1.0662e-04 3.7930e-04 -6.0000e+00 2.0863e-02 -1.5624e-04 1.9471e-04 12 8 8 10 0 0 99.77 22.82 0.56 -0.00016 -0.00795 13 2 1 5 0 3805.300 25.68 20.00 22.82 3.61 26.0 1026.51 139236 279803 900000 148080 209225 250720 147727 299058 172886 71248 17922 67413 48958 136622 217719 113016 78717 -88433 193789 172221 173495 128868 110058 72536 38931 25818 62344 7992 23990 35693 52729 86010 54505 60365 65497 115287 47978 37315 47676 33870 8330 8546 -253 9099 15669 38106 22430 47108 40502 38777 29668 24387 19188 25571 22277 8900 7762 -3320 -5317 -8455 -2998 7020 5069 1042 8662 4840 13706 6478 8001 1323 -5621 -3704 -3180 -9909 -4816 -8813 -6181 -1321 -8454 -3631 -3296 916 -1782 -4159 -8316 -7508 -8121 -5409 -7657 -3308 -3581 -4391 -2752 -4468 -8021 -4961 -5335 -2045 732 -639 2133 2150 1500 1910 807 -960 -817 161 -135 2328 1742 -582 1068 -490 -1762 -394 573 1771 1597 2172 78 1941 3550 4828 2494 3248 1640 3249 2954 1995 4387 3695 3350 2115 1463 83 -189 -1106 -1783 -2841 -1521 -2836 -2790 -4493 7222 4722 900000 9291 6615 4465 5639 2247 3719 3465 1285 3041 3203 5374 5386 9303 10244 -54458 9911 11066 10879 11476 10372 8298 5169 3408 5487 1155 3139 4662 6896 9881 9632 10765 10976 11360 8430 7400 9114 7754 2491 2630 -88 3101 5354 11417 8092 14189 13222 13012 10982 9818 8422 10901 9800 4254 3606 -1627 -2579 -4230 -1496 3501 2839 664 5525 3224 8156 3914 4727 870 -4200 -2863 -2471 -7948 -3545 -6278 -3993 -780 -5380 -2420 -2472 735 -1570 -3898 -8299 -7755 -8805 -5980 -8808 -3697 -3916 -4605 -2665 -4174 -7694 -4973 -5904 -2450 936 -868 2847 2743 1806 2191 936 -1174 -1042 212 -185 3306 2629 -933 1725 -790 -2756 -584 819 2520 2340 3311 125 3103 5554 7332 3756 4724 2342 4477 4133 2948 6784 6004 5622 3645 2594 153 -359 -2144 -3501 -5627 -2940 -5385 -5111 -8156 SS 20210210T140735.8Z 7711.588609 115 1 49.62 2 69.17 132.29 70.38 148.69 0.00 1 0.00 1 0 25 8.891e-02 1.152e-02 1.683e-02 2.386e-03 3.947095e-01 1.225230e-03 4.684018e-03 -6.000000e+00 5.214274e-02 224.71 -2.00 3.51 -2.00 318.45 0.00e+00 7.508378e-04 2.442497e-04 2.155086e-04 -6.000000e+00 2.263540e-03 275.26 -2.00 20.00 -2.00 317.87 0.00e+00 2.785 0.000 302.00 328.00 3 4.2426e+00 3.2889e-03 3.4187e-02 -6.0000e+00 1.2885e-01 6.0698e-02 3.7431e-03 2.0139e-02 -6.0000e+00 1.4007e-01 -2.2709e-02 2.5593e-03 1.0017e-02 -6.0000e+00 8.3355e-02 2.3409e-03 1.3333e-03 2.9967e-03 -6.0000e+00 3.5000e-02 2.8602e-04 -2.3213e-04 7.3119e-05 3.5765e-05 -6.0000e+00 2.6496e-03 -1.2575e-03 1.0498e-04 12 9 8 11 32 0 99.91 22.83 0.30 -0.00126 -0.00300 19 4 1 5 0 2610.760 25.68 19.99 22.83 4.08 26.2 1026.58 -28321 20807 -16961 -36902 -7317 4528 -21273 42158 8545 -23677 -34152 -11840 -16392 13029 32191 -7152 -22753 503 22653 11483 16485 3431 3994 -4577 -4665 -4024 13000 -8087 -5599 -3883 -130 6233 -5714 -4151 -1384 610 -4765 -3514 1366 3765 -851 -532 -3297 -2016 -1584 4871 -2752 4317 1842 2881 598 -607 -2237 3107 4043 2057 4267 2159 2305 696 -29 3529 634 -639 -609 -2201 3086 -476 2544 1067 -2073 -307 713 -1219 877 -1144 465 2530 -1195 289 -1020 554 -1462 -1240 -2375 -1136 -1884 -435 714 -406 -342 132 577 686 -477 885 -834 200 56 -1344 -839 -262 -96 1087 119 -465 -441 -306 -98 828 645 -619 135 -197 -228 526 550 1272 320 168 -1254 -408 125 794 95 40 -207 701 721 752 897 364 579 323 395 -216 87 259 -287 -826 28 -544 -376 -512 -1397 743 -913 -2373 -337 176 -1077 1304 404 -1629 -2692 -794 -1273 901 2188 -799 -3202 61 2364 1393 1967 467 548 -712 -772 -698 1971 -1461 -954 -642 -22 1081 -1220 -930 -305 129 -1082 -875 381 1196 -314 -211 -1387 -860 -680 1995 -1199 1774 773 1217 266 -290 -1155 1622 2191 1167 2440 1265 1344 406 -17 2089 409 -446 -444 -1624 2113 -325 1717 779 -1679 -259 612 -1053 720 -901 337 1712 -828 210 -821 481 -1383 -1232 -2472 -1226 -2133 -504 834 -475 -390 143 592 677 -474 917 -942 243 72 -1824 -1128 -338 -117 1272 143 -580 -573 -410 -135 1187 970 -977 215 -311 -348 767 776 1785 462 253 -1955 -640 193 1203 142 58 -291 959 995 1083 1360 577 940 537 673 -381 157 480 -539 -1559 51 -988 -664 -893 SS 20210210T141331.6Z 7711.592726 118 1 51.10 2 68.35 133.56 69.81 149.97 0.00 1 0.00 1 0 17 4.464e-01 6.522e-02 3.167e-02 2.741e-03 3.578610e-01 1.399350e-03 4.153507e-03 -6.000000e+00 2.628319e-01 224.71 -2.00 3.51 -2.00 318.17 0.00e+00 2.558866e-02 2.571643e-04 7.633776e-04 -6.000000e+00 1.140026e-02 275.26 -2.00 20.00 -2.00 317.62 0.00e+00 2.686 0.000 302.00 328.00 3 4.5666e+00 3.7215e-03 3.5503e-02 -6.0000e+00 6.4957e-01 2.6561e-01 4.1749e-03 3.7265e-02 -6.0000e+00 7.0569e-01 -3.7574e-01 2.5857e-03 1.3993e-02 -6.0000e+00 4.1956e-01 1.9840e-01 1.3383e-03 2.0787e-02 -6.0000e+00 1.7783e-01 2.1677e-04 3.1685e-03 8.1886e-05 1.9878e-04 -6.0000e+00 1.3381e-02 -7.4798e-03 8.4521e-04 12 9 8 11 8 0 99.90 22.83 0.41 -0.00748 0.01633 13 2 1 5 0 3929.560 25.68 20.01 22.83 4.02 26.1 1025.85 900000 158644 315240 85018 108439 129568 88098 127622 83669 30557 12806 35379 25366 64137 94913 57975 44298 -98810 99646 84798 84388 67174 56316 37325 19572 11920 29244 3137 11145 16878 32156 41835 29941 29676 33656 54826 22409 18153 22392 12598 701 1353 -3229 2609 5232 17991 8870 22691 19238 19941 15719 11649 9824 12311 12009 3755 3091 -4189 -5163 -5703 -2935 3821 1204 251 3683 2331 7336 2282 4207 1151 -4481 -3048 -2692 -6085 -3158 -6322 -4092 -1581 -4288 -2765 -2534 -479 -2497 -3141 -5710 -4036 -5157 -3546 -4601 -2076 -1881 -1930 -1469 -2287 -4294 -2090 -2502 -934 436 -29 1290 927 1523 1403 702 -743 -493 -225 166 1703 1326 58 1000 -304 -670 39 701 1824 1093 1547 -83 1261 2081 1975 1897 1883 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