File name: Pandora55s1_QueensNY_20210624_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T191202.2Z 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_20210624_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: 20210624 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 20210624T101018.1Z 7845.423821 203 1 50.26 2 83.34 64.72 102.40 246.73 0.00 1 0.00 1 0 25 7.853e-01 4.215e-02 2.702e-01 1.011e-02 1.026696e+00 6.679386e-03 1.266626e-02 -6.000000e+00 5.233407e-01 232.90 -2.00 3.51 -2.00 322.34 0.00e+00 -1.707549e-02 4.090650e-03 1.849005e-02 -6.000000e+00 2.799594e-02 287.56 -2.00 20.00 -2.00 321.86 0.00e+00 7.832 0.009 302.00 328.00 3 7.6745e-01 2.7884e-02 1.4220e-01 -6.0000e+00 1.3194e+00 1.6133e+00 3.5930e-02 1.5048e-01 -6.0000e+00 1.4420e+00 -2.2741e+00 2.4078e-02 6.0606e-02 -6.0000e+00 8.4339e-01 9.1532e-01 1.1191e-02 8.6510e-03 -6.0000e+00 3.4714e-01 3.3481e-05 -3.6920e-03 3.0326e-04 3.2231e-04 -6.0000e+00 2.6546e-02 9.7299e-03 -5.5182e-05 12 8 8 10 0 0 -7.26 22.81 0.53 0.00973 -0.01801 37 7 1 5 0 1358.210 25.68 19.97 22.81 23.25 29.0 1071.06 296369 900000 900000 36118 900000 900000 34804 900000 900000 237563 49344 91853 43214 -81603 900000 134423 40043 900000 900000 900000 900000 900000 900000 2401 218331 900000 900000 62488 46276 31322 98539 900000 192349 -50976 900000 900000 101150 124446 900000 900000 171051 900000 60629 81400 187773 900000 26386 900000 900000 900000 34908 64377 21167 900000 900000 98990 900000 343953 900000 96111 131054 900000 109420 -380 141326 -10050 110348 6001 152646 47279 15396 40289 88309 21389 121544 32275 58193 64579 13513 15116 -581 50911 20451 22672 -6564 9151 -2184 4733 -10702 10205 -5563 -3558 878 851 465 4875 -10272 -7128 -1962 -8100 -3889 -2708 -687 8070 -867 512 -926 -1936 -1055 5934 861 -8911 -2158 -1885 -4092 -1931 1070 4321 -478 1077 -4952 -549 6936 11445 -739 2213 561 126 711 -3941 -679 3693 2266 930 1368 -218 1349 969 243 -1146 -1962 -332 -208 -2187 2902 900000 900000 1912 900000 900000 1257 900000 900000 2326 1830 2284 1823 -12220 900000 2977 2258 900000 900000 900000 900000 900000 900000 155 2138 900000 900000 2189 1653 1192 2013 900000 1939 -5568 900000 900000 2257 2411 900000 900000 3293 900000 3581 3769 2887 900000 1693 900000 900000 900000 2302 3533 1912 900000 900000 5204 900000 3367 900000 4764 4299 900000 4644 -51 5387 -1674 5926 883 6016 5682 2784 6166 8734 3812 7722 4245 5395 5418 1944 2437 -129 8164 4987 5952 -2421 3081 -855 1801 -4754 3672 -2219 -1322 302 298 177 2063 -5857 -4593 -1379 -6546 -3077 -2013 -455 4562 -527 322 -627 -1402 -822 4879 849 -10831 -2707 -2460 -5481 -2502 1333 5291 -635 1471 -7277 -763 8662 13231 -925 2653 666 149 889 -5804 -1115 6543 4421 1964 3080 -528 3374 2481 630 -2978 -4942 -778 -453 -4659 SS 20210624T102121.7Z 7845.431501 206 1 50.03 2 81.43 66.41 104.25 248.28 0.00 1 0.00 1 0 25 6.545e-01 2.067e-02 2.059e-01 3.549e-03 8.864399e-01 2.115002e-03 9.798091e-03 -6.000000e+00 4.067738e-01 232.90 -2.00 3.51 -2.00 321.75 0.00e+00 7.173068e-03 1.254380e-03 3.221072e-03 -6.000000e+00 1.927890e-02 287.56 -2.00 20.00 -2.00 321.22 0.00e+00 6.319 0.005 302.00 328.00 3 7.1453e-01 8.2320e-03 8.4386e-02 -6.0000e+00 1.0285e+00 4.6215e-01 1.2087e-02 6.3871e-02 -6.0000e+00 1.1192e+00 -6.4249e-01 1.1850e-02 2.5924e-02 -6.0000e+00 6.6039e-01 2.6392e-01 5.3126e-03 1.4690e-02 -6.0000e+00 2.7081e-01 1.8724e-04 -2.3208e-03 9.8413e-05 1.4503e-04 -6.0000e+00 2.0139e-02 8.4838e-03 -7.7808e-06 12 8 8 10 0 0 10.74 22.79 0.29 0.00848 -0.00896 96 18 1 5 0 521.020 25.68 20.00 22.79 24.43 28.9 1077.07 -186370 900000 900000 -265714 5153 -110708 -198514 900000 -98402 -146153 -167793 -156910 -163339 -266911 900000 -82197 -127495 900000 900000 900000 900000 900000 -282 -86394 2036 -30922 900000 -76720 -52231 -88885 22746 80254 18004 -81342 109269 900000 -7865 -3814 262640 98205 7238 82012 -374 20070 31651 125841 -937 87980 42409 52354 12979 15638 4682 36367 59718 18341 41144 19174 34561 17632 17748 30600 12553 3725 20410 1273 14080 3419 14705 10797 5239 6991 10407 4032 10963 1320 7798 5020 2730 -568 -27 4616 1500 540 -2371 -1508 -3156 -2257 -3524 -227 -1501 635 -953 -1137 -851 1031 -2231 -1870 -1318 -2072 -1322 -1094 597 1093 -880 -2184 -893 -1809 -1007 321 -253 -2906 -751 -39 -555 533 843 1262 336 267 -1319 144 1605 2002 227 698 1299 1791 1258 -690 618 1061 1285 659 417 -242 111 19 -474 -636 -612 -447 -452 -261 -1369 900000 900000 -5652 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-6.000000e+00 1.266604e-02 287.56 -2.00 20.00 -2.00 320.32 0.00e+00 5.035 0.002 302.00 328.00 3 5.8492e-01 2.7883e-03 6.5116e-02 -6.0000e+00 7.0783e-01 9.6798e-02 3.8089e-03 4.2602e-02 -6.0000e+00 7.6365e-01 -8.5534e-02 3.7392e-03 2.0923e-02 -6.0000e+00 4.5502e-01 2.2341e-02 1.7829e-03 1.0327e-02 -6.0000e+00 1.9046e-01 8.5695e-04 -1.2343e-03 4.1654e-05 9.2818e-05 -6.0000e+00 1.3979e-02 7.8051e-03 2.0122e-05 11 8 0 10 0 0 15.64 22.80 0.26 0.00781 -0.00147 222 42 1 5 0 222.840 25.68 20.00 22.80 25.41 29.0 1082.23 -186876 -68105 900000 -193659 -113816 -134989 -185133 -36049 -112431 -144327 -129474 -150662 -106472 -163921 146710 -67359 -43016 -26344 43268 2476 -10870 -3424 -29078 -37099 -45097 -16960 18561 -36289 -38557 -35306 -22150 -1040 -8188 -25722 -5333 12559 -6658 -10935 17696 1246 -2625 1965 -5821 -4299 -629 10045 -1932 7575 1332 6155 -379 3859 -331 6571 5317 1555 3627 880 2459 -308 3366 3189 3444 -527 2580 81 3551 1030 2716 2291 62 593 356 -222 146 -184 629 1609 642 596 -37 170 -1042 -1105 -1135 -1751 -1278 -1141 -674 -604 256 496 755 1064 1138 1358 156 819 -560 -555 -521 -236 249 1098 -395 -1532 -750 -845 -102 -171 -32 -683 -113 -96 6 573 1071 1013 379 -205 -1007 -232 143 49 38 91 336 1449 798 -122 241 48 483 226 283 -450 -115 79 -399 -596 -228 -13 94 318 -1240 -172 900000 -2005 -514 -735 -1745 -86 -657 -1284 -1083 -1780 -1018 -3699 214 -957 -571 -339 310 29 -153 -46 -521 -773 -1114 -340 271 -925 -1019 -965 -620 -29 -297 -1149 -219 430 -290 -524 777 78 -200 160 -551 -422 -61 909 -204 762 151 717 -48 530 -53 1091 968 312 744 189 515 -65 691 697 845 -153 751 25 1070 322 893 854 27 276 171 -105 64 -74 229 559 238 254 -19 94 -664 -772 -848 -1314 -1012 -946 -568 -503 203 369 565 781 883 1117 152 862 -639 -684 -642 -272 272 1106 -405 -1682 -866 -977 -126 -234 -47 -1050 -184 -158 10 867 1645 1567 585 -335 -1706 -386 227 79 59 137 485 2025 1175 -193 430 90 929 461 589 -1008 -258 182 -934 -1394 -512 -28 203 664 SS 20210624T104134.5Z 7845.445538 214 1 49.19 2 77.88 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