File name: Pandora55s1_QueensNY_20210119_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T175200.9Z 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_20210119_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: 20210119 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 20210119T130918.2Z 7689.548127 68 1 50.30 2 82.04 125.52 120.68 57.25 0.00 1 0.00 1 0 25 6.634e-01 3.694e-02 2.323e-01 6.989e-03 9.633415e-01 4.122998e-03 1.078055e-02 -6.000000e+00 4.025717e-01 223.91 -2.00 3.51 -2.00 321.93 0.00e+00 -2.430938e-03 2.058351e-03 3.834986e-03 -6.000000e+00 1.919633e-02 275.32 -2.00 20.00 -2.00 321.49 0.00e+00 6.750 0.006 302.00 328.00 3 1.2463e+00 1.4362e-02 8.6021e-02 -6.0000e+00 9.9740e-01 1.1893e+00 1.8911e-02 5.6594e-02 -6.0000e+00 1.0928e+00 -1.5652e+00 1.6351e-02 3.0348e-02 -6.0000e+00 6.4598e-01 6.2643e-01 7.8140e-03 9.3906e-03 -6.0000e+00 2.6770e-01 6.2292e-05 -3.1940e-03 1.9334e-04 1.7019e-04 -6.0000e+00 2.1185e-02 -6.6858e-04 -8.4001e-05 12 8 8 10 0 0 99.90 22.80 0.30 -0.00067 -0.02467 56 11 1 5 0 897.940 25.68 19.99 22.80 7.87 26.7 1036.67 -58132 122854 900000 -107727 900000 900000 -3073 900000 59504 86768 -145498 -32463 -111620 -10446 900000 48695 -61959 900000 900000 900000 900000 88873 118367 15713 32504 12968 900000 -31892 -1223 -70331 66686 192198 21793 12552 191961 900000 5494 36231 900000 345813 85506 93975 19345 13184 151052 900000 9335 209939 124516 86097 26377 57655 17413 200802 137075 80980 131278 84047 76437 48886 30666 85358 20031 -1249 56288 5416 65385 13634 37527 33942 3515 22683 40447 2804 30872 3618 29069 34804 -9560 8881 1019 21468 1177 4406 -6336 6358 -4546 -461 -11061 1709 824 -3069 4786 -4701 -8634 1049 -7314 -6169 -4562 -6512 -2719 -2835 -1836 1119 947 863 -2720 -1216 -1563 2439 -1118 -4568 -883 -1427 -1045 583 929 1901 -489 667 -1933 1251 4030 5548 435 1845 1428 2267 53 -977 -303 2516 2020 826 1386 -413 1418 793 1106 -4341 158 -933 -578 -1470 -2084 869 900000 -6266 900000 900000 -49 900000 577 665 -10099 -834 -6843 -301 900000 1111 -4342 900000 900000 900000 900000 1504 1455 522 973 478 900000 -1646 -45 -4781 1397 1425 942 635 1782 900000 275 1467 900000 2352 3340 3640 1534 1102 3430 900000 757 2651 3656 3820 2197 3969 1904 4371 5763 5961 6277 6189 5829 4517 3205 5454 2536 -216 6367 1031 7245 2482 5822 6064 924 5348 8249 777 6091 826 4733 5198 -2268 2038 298 6077 457 1817 -3075 2891 -2380 -241 -6450 874 408 -1492 2082 -2239 -4596 585 -5138 -4984 -4123 -6496 -2663 -2635 -1539 840 697 661 -2274 -1059 -1475 2474 -1327 -6242 -1266 -2130 -1553 838 1309 2669 -724 1017 -3070 1900 5726 7490 596 2440 1854 2888 73 -1503 -529 4751 4128 1808 3198 -1021 3591 2057 2873 -11666 398 -2236 -1295 -3184 SS 20210119T132037.5Z 7689.555990 71 1 9.03 2 80.31 127.56 118.88 59.62 0.00 1 0.00 1 0 33 6.017e-01 2.734e-02 2.889e-01 1.058e-02 8.383470e-01 6.102192e-03 9.393239e-03 -6.000000e+00 3.694962e-01 223.91 -2.00 3.51 -2.00 321.33 0.00e+00 1.568183e-02 2.907058e-03 3.493728e-03 -6.000000e+00 1.746818e-02 275.32 -2.00 20.00 -2.00 320.88 0.00e+00 5.674 0.003 302.00 328.00 3 1.7599e+00 1.9979e-02 7.7616e-02 -6.0000e+00 9.2202e-01 5.9585e-01 2.7323e-02 6.2695e-02 -6.0000e+00 1.0154e+00 -6.9240e-01 2.7733e-02 2.4566e-02 -6.0000e+00 5.9303e-01 2.8228e-01 1.3188e-02 1.9753e-02 -6.0000e+00 2.4232e-01 1.1642e-04 -2.7696e-03 2.9813e-04 1.7185e-04 -6.0000e+00 1.9377e-02 2.0797e-03 -9.0238e-05 12 9 9 12 1 1 -721.11 22.79 0.36 0.00208 -0.01873 5 6 1 5 0 1474.090 25.68 20.00 22.79 8.07 26.7 1037.63 -267697 900000 900000 -210559 108283 900000 -149048 900000 900000 -126889 -146989 -157783 -68118 -154215 900000 8575 -106905 900000 900000 900000 900000 900000 38357 -33793 -43039 6226 900000 23772 -68979 -100179 73881 64934 3951 -8254 900000 900000 79246 -33337 900000 124945 22658 18892 -8169 21937 48120 306983 -17489 117304 48197 87280 7843 29782 -7024 52169 57704 38941 39096 8851 35073 4462 15070 24078 14242 -6854 25775 5662 18736 1631 11600 9056 -909 11694 9671 2981 2754 667 6412 15719 -3257 8936 1476 4186 1796 -1427 -6333 -443 -2689 -3900 -6728 -1108 5 -1654 -109 -539 -6565 854 -5745 -2263 -3491 -1745 -1536 851 1403 1377 415 -1343 -1144 -619 915 1371 157 -2214 -198 787 -891 57 -81 1588 -1152 208 -1628 304 2789 3014 -730 1423 -15 2386 905 -1325 736 1281 1879 648 1083 -383 842 913 -921 -793 -923 -1572 -1271 241 -10893 900000 900000 -6854 1114 900000 -2191 900000 900000 -1597 -2300 -3036 -704 -4905 900000 98 -4353 900000 900000 900000 900000 900000 492 -858 -1208 111 900000 355 -2523 -5304 901 1080 141 -369 900000 900000 1544 -2035 900000 2302 1234 1158 -683 1453 2576 3159 -1842 3687 3079 4163 855 2936 -1075 5003 5596 4649 4753 1416 4297 706 2158 3355 2434 -1619 5038 1409 4173 431 2952 2619 -318 3925 3365 1066 920 207 1727 3780 -988 2783 582 1863 917 -811 -3965 -276 -1787 -2718 -4883 -761 3 -1048 -65 -320 -4350 597 -4884 -2139 -3722 -1966 -1745 902 1357 1240 372 -1266 -1128 -637 991 1612 207 -3233 -300 1209 -1369 84 -118 2298 -1748 323 -2615 476 4152 4329 -1051 1966 -20 3154 1258 -2052 1242 2337 3616 1312 2291 -853 1924 2117 -2170 -1858 -2112 -3453 -2650 482 SS 20210119T133819.5Z 7689.568281 84 1 50.95 2 77.71 130.86 116.00 63.17 0.00 1 0.00 1 0 25 3.358e-01 7.141e-03 8.074e-02 9.683e-04 7.081389e-01 5.149310e-04 8.146954e-03 -6.000000e+00 1.962821e-01 223.91 -2.00 3.51 -2.00 320.51 0.00e+00 2.954793e-03 2.000127e-04 1.757378e-03 -6.000000e+00 8.548901e-03 275.32 -2.00 20.00 -2.00 320.02 0.00e+00 4.564 0.002 302.00 328.00 3 3.7413e-01 1.5377e-03 5.9063e-02 -6.0000e+00 4.8414e-01 1.0851e-01 2.0012e-03 3.9364e-02 -6.0000e+00 5.2665e-01 -7.0720e-02 2.0495e-03 1.9203e-02 -6.0000e+00 3.1358e-01 1.5481e-02 1.0264e-03 6.8874e-03 -6.0000e+00 1.3188e-01 1.7257e-03 -1.2303e-03 2.6765e-05 7.4951e-05 -6.0000e+00 1.0004e-02 -2.7265e-03 5.3980e-06 11 8 0 10 0 0 41.07 22.80 0.24 -0.00273 -0.01197 353 67 1 5 0 142.690 25.68 19.99 22.80 9.24 27.2 1044.93 -119833 -104156 88300 -148342 -89925 -101219 -126138 -60211 -101650 -79818 -135070 -66324 -100134 -47827 -19398 -34936 -42564 -49045 -1003 -6875 571 -20641 -9963 -29577 -12027 -24048 1745 -20058 -21239 -22369 -10641 1063 -8184 -5844 -5102 9848 -7473 -2494 -808 2415 -1687 -1349 -3986 -2968 221 3579 285 913 2657 995 832 1932 935 3525 2705 2515 1907 1238 601 1191 558 2970 1829 852 1157 594 2492 1167 2969 1465 504 -304 46 -747 -456 -450 789 1325 1009 252 -225 -139 -1905 -1270 -1743 -1141 -1257 -847 -714 -403 410 606 1090 1271 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