File name: Pandora55s1_QueensNY_20210519_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T184602.3Z 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_20210519_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: 20210519 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 20210519T102937.8Z 7809.437242 109 1 50.50 2 81.21 71.31 121.45 351.81 0.00 1 0.00 1 0 41 1.587e+00 1.834e-01 2.846e-01 2.254e-02 6.472504e-01 1.468633e-02 1.493840e-02 -6.000000e+00 1.038376e+00 231.34 -2.00 3.51 -2.00 313.98 0.00e+00 1.798811e-01 3.598349e-03 1.525093e-02 -6.000000e+00 5.055355e-02 284.04 -2.00 20.00 -2.00 313.82 0.00e+00 6.182 0.004 302.00 328.00 3 2.6436e+00 4.1597e-02 2.3752e-01 -6.0000e+00 2.6068e+00 3.2158e+00 4.6246e-02 4.0058e-01 -6.0000e+00 2.8366e+00 -3.0662e+00 2.3855e-02 2.7750e-02 -6.0000e+00 1.6561e+00 1.0176e+00 1.4518e-02 1.5903e-01 -6.0000e+00 6.9955e-01 1.1078e-05 3.6971e-03 6.1513e-04 2.1840e-03 -6.0000e+00 5.4537e-02 4.1035e-03 1.0819e-03 12 8 8 10 0 0 99.99 22.86 1.50 0.00410 0.03189 13 2 1 5 0 3883.510 25.79 19.97 22.86 25.47 28.7 1100.00 900000 900000 900000 562232 816685 900000 396057 900000 900000 248736 126034 60110 29408 251270 900000 481905 269074 -4869 900000 900000 900000 900000 900000 250419 106121 -10617 900000 47158 82379 87118 900000 351524 220932 162407 490767 900000 167994 101017 900000 900000 49251 900000 -5173 215441 125422 900000 114455 900000 900000 900000 120413 118282 94670 900000 900000 312901 900000 900000 900000 38975 92887 256117 50668 27240 249431 3323 194569 11099 900000 151075 -13896 42198 263513 -12058 900000 -1201 23645 900000 -8548 35493 15251 158668 49605 75847 -15884 17876 -13266 -99 -29886 18451 -29764 -13565 -9821 -15965 -19334 8208 -37688 2732 24565 -1853 19493 9546 11007 36085 7528 -4003 9194 9916 -3657 36877 7741 -19670 6851 -9631 -20178 -11965 -7022 11326 -5610 7007 -10250 -3945 17655 29895 -3970 -7686 -1601 -1347 -607 -5300 12078 14321 15071 11661 12232 2785 8589 139 4324 -23052 -4713 2823 7715 -687 900000 900000 900000 72628 17830 900000 47406 900000 900000 7932 7567 6251 6810 16296 900000 11932 69228 -17734 900000 900000 900000 900000 900000 16155 11686 -1806 900000 3360 5789 9622 900000 8818 25690 34939 10715 900000 19211 17024 900000 900000 6432 900000 -1051 6334 10985 900000 17131 900000 900000 900000 21672 21185 20268 900000 900000 6831 900000 900000 900000 4848 8279 5983 10633 8529 10737 1532 14166 4238 900000 14354 -6335 11148 7830 -4416 900000 -308 4358 900000 -2380 8097 5200 16004 14963 18064 -8872 7317 -7408 -50 -20531 8076 -19799 -7184 -4537 -7345 -9545 3646 -31707 1937 16735 -1770 15344 7609 7611 17610 4628 -2818 6047 6947 -3190 24689 7648 -27272 7789 -12571 -27831 -14653 -8168 11655 -7242 8643 -15290 -5534 19576 28547 -4985 -9648 -1854 -1552 -744 -7698 17149 21932 24506 20528 22387 5784 17541 313 9512 -64597 -11051 5923 14698 -1371 SS 20210519T104216.8Z 7809.446028 114 1 50.36 2 78.92 73.24 121.74 355.18 0.00 1 0.00 1 0 25 6.761e-01 2.388e-02 1.733e-01 4.013e-03 7.620270e-01 2.339729e-03 8.503881e-03 -6.000000e+00 4.219201e-01 231.34 -2.00 3.51 -2.00 321.34 0.00e+00 8.207700e-03 1.188494e-03 1.041760e-03 -6.000000e+00 2.055997e-02 284.04 -2.00 20.00 -2.00 320.79 0.00e+00 5.020 0.002 302.00 328.00 3 2.4048e+00 8.1238e-03 6.6258e-02 -6.0000e+00 1.0633e+00 2.6613e-01 1.1163e-02 4.5860e-02 -6.0000e+00 1.1582e+00 -4.3586e-01 1.0748e-02 2.2579e-02 -6.0000e+00 6.7972e-01 1.7827e-01 5.0112e-03 1.3157e-02 -6.0000e+00 2.7959e-01 1.3748e-04 -1.6998e-03 1.1763e-04 1.3776e-04 -6.0000e+00 2.1247e-02 2.9298e-03 4.3212e-05 12 8 8 10 0 0 23.58 22.86 0.40 0.00293 -0.00984 50 9 1 5 0 1007.030 25.68 20.01 22.86 26.30 28.9 1100.00 -231318 900000 900000 -250016 900000 900000 -183584 900000 900000 -127438 -186976 -174595 -225919 -6601 900000 136900 -145100 900000 900000 900000 23926 108744 416857 -45853 -5335 -61076 900000 -64228 12001 -60399 14609 19562 25156 -44600 26212 900000 -27300 -2620 82147 68166 253 80040 -11502 28061 17873 103270 14998 40756 62778 19813 17224 2460 6336 33874 47803 25048 25498 21031 35491 9252 6551 23237 4111 988 13109 -3451 8795 -353 12050 11142 -925 3113 11240 -2322 13462 -2178 6597 7410 -1824 -1181 -1693 4306 27 248 -4699 -885 -4725 -873 -4139 67 -3992 -803 1317 -718 -442 140 -2869 -1442 -561 -2854 -225 -922 698 1483 370 -1600 -976 -125 -2027 1168 -606 -2243 -562 -614 -816 310 554 2410 88 -102 -954 227 1569 2279 1075 -115 1237 1742 1017 -554 620 884 1148 1449 759 133 73 255 -224 -2636 -709 -99 207 -527 -4532 900000 900000 -7963 900000 900000 -2782 900000 900000 -1395 -3816 -3520 -9069 -42 900000 535 -6594 900000 900000 900000 293 587 1628 -1150 -96 -1949 900000 -2143 195 -2064 283 442 642 -2445 758 900000 -1312 -111 1858 2090 17 2756 -992 1748 1257 3352 1145 2545 3359 1687 1635 298 822 3702 4944 3349 3519 3043 4448 1442 1050 3360 790 221 2894 -930 2121 -93 3013 3116 -323 1130 3881 -888 4198 -719 1849 1987 -560 -408 -690 1919 14 139 -2914 -560 -3260 -607 -3021 47 -2804 -522 801 -440 -283 100 -2394 -1351 -581 -3218 -250 -981 677 1342 338 -1550 -988 -132 -2314 1410 -814 -3316 -862 -956 -1252 458 799 3444 133 -159 -1542 361 2401 3370 1565 -164 1708 2360 1438 -863 1056 1622 2218 2917 1606 295 168 599 -532 -6356 -1651 -220 440 -1097 SS 20210519T104835.4Z 7809.450410 117 1 50.22 2 77.78 74.20 121.84 356.86 0.00 1 0.00 1 0 25 6.588e-01 1.359e-02 1.870e-01 2.628e-03 7.107953e-01 1.479295e-03 7.969111e-03 -6.000000e+00 4.013712e-01 231.34 -2.00 3.51 -2.00 320.98 0.00e+00 5.877686e-03 6.845695e-04 1.453241e-03 -6.000000e+00 1.801359e-02 284.04 -2.00 20.00 -2.00 320.39 0.00e+00 4.584 0.002 302.00 328.00 3 2.1530e+00 4.8717e-03 6.1009e-02 -6.0000e+00 1.0084e+00 7.5329e-02 6.5751e-03 4.2206e-02 -6.0000e+00 1.0932e+00 -1.3236e-01 6.4588e-03 2.0273e-02 -6.0000e+00 6.4783e-01 4.4642e-02 3.0883e-03 1.0759e-02 -6.0000e+00 2.6976e-01 2.8809e-04 -1.1579e-03 7.6247e-05 9.5664e-05 -6.0000e+00 2.0092e-02 2.4771e-03 4.1491e-05 12 8 8 10 0 0 54.32 22.86 0.24 0.00248 -0.00622 80 15 1 5 0 627.570 25.68 19.98 22.86 26.80 28.8 1100.00 -247105 900000 900000 -229374 43633 67845 -176502 900000 2019 -149433 -186857 -152965 -169360 -83964 900000 -13096 -98312 -95246 900000 900000 -15215 25036 54080 -27705 -47879 -47370 501786 -54814 -25329 -54031 -11641 304 -13968 -40650 2956 87473 -13257 -16353 24481 15574 -7155 13402 -12264 5317 2986 37477 -4967 21276 16560 8180 303 842 -545 14278 12859 7679 9246 5646 10717 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