File name: Pandora55s1_QueensNY_20210313_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T181351.2Z 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_20210313_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: 20210313 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 20210313T115212.2Z 7742.494586 59 1 50.42 2 82.84 99.87 88.53 101.32 0.00 1 0.00 1 0 25 6.445e-01 3.036e-02 2.336e-01 6.403e-03 9.735786e-01 3.876346e-03 1.063289e-02 -6.000000e+00 3.944322e-01 226.09 -2.00 3.51 -2.00 322.07 0.00e+00 2.189838e-02 2.154422e-03 9.702615e-03 -6.000000e+00 1.955398e-02 276.97 -2.00 20.00 -2.00 321.65 0.00e+00 7.392 0.007 302.00 328.00 3 4.2336e-01 1.4149e-02 1.1873e-01 -6.0000e+00 9.7782e-01 1.3408e+00 1.7978e-02 1.2108e-01 -6.0000e+00 1.0670e+00 -1.7050e+00 1.5711e-02 2.8858e-02 -6.0000e+00 6.3243e-01 6.8594e-01 7.5254e-03 2.7462e-02 -6.0000e+00 2.6743e-01 6.8720e-05 -2.7035e-03 1.7809e-04 2.2807e-04 -6.0000e+00 2.0733e-02 9.2132e-05 4.8010e-05 12 8 8 10 0 0 23.47 22.77 0.45 0.00009 -0.02022 57 11 1 5 0 884.310 25.68 20.00 22.77 6.41 26.8 1032.13 7259 900000 900000 -95917 106323 900000 -34290 900000 284461 -78399 -121040 900000 -62120 186121 900000 45292 -98746 -52800 900000 900000 900000 175201 900000 -6855 69711 50394 900000 -25172 82554 -55063 79381 900000 48744 -24428 100834 900000 70791 62471 900000 900000 17551 123812 9095 146987 23309 900000 28720 900000 154142 235063 107456 29282 17714 149284 161400 85710 125342 82948 88552 54070 46851 67442 14058 -5536 53373 14884 69570 13965 43966 39564 6502 15952 43513 -980 33517 5317 25632 44406 -4444 -588 9118 17521 5415 10321 -3600 2162 -4484 -1824 -7694 1606 -6106 -7525 1255 636 -4459 -1569 -5976 -3701 -1761 -3785 -1591 -415 -1440 2418 816 -769 -1555 26 -3249 1341 -1318 -5155 -850 -2927 -2575 -759 2 2333 -231 1039 -1065 1545 3992 3573 835 1788 1075 1706 2055 -898 1010 1912 875 1046 530 -127 379 393 -234 -985 136 -266 -1012 -2249 130 900000 900000 -5380 733 900000 -674 900000 1770 -1852 -4109 900000 -1561 1158 900000 897 -8866 -3359 900000 900000 900000 1139 900000 -222 1016 833 900000 -778 893 -2416 1145 900000 1432 -1572 1947 900000 1630 1623 900000 900000 941 2546 578 2580 1349 900000 1641 900000 2938 2184 3712 2326 1718 4463 4486 4974 4982 4785 4634 3731 3414 4230 1627 -879 5503 2339 6662 2286 5747 5950 1470 3526 7514 -244 5553 1027 3720 5264 -894 -133 2276 4754 1865 3704 -1553 926 -2132 -877 -3961 755 -2963 -3516 516 264 -2089 -829 -3874 -2766 -1483 -3544 -1492 -366 -1160 1718 572 -567 -1222 21 -2973 1317 -1506 -6841 -1177 -4266 -3735 -1066 2 3176 -334 1547 -1646 2296 5563 4805 1117 2319 1375 2156 2726 -1374 1736 3618 1804 2288 1231 -312 964 1017 -610 -2572 342 -633 -2270 -4893 SS 20210313T120221.4Z 7742.501637 62 1 50.80 2 80.95 101.58 86.68 102.92 0.00 1 0.00 1 0 25 6.550e-01 1.489e-02 1.880e-01 2.537e-03 8.436667e-01 1.427757e-03 9.263918e-03 -6.000000e+00 3.916219e-01 226.09 -2.00 3.51 -2.00 321.45 0.00e+00 6.686238e-03 7.225803e-04 2.558569e-03 -6.000000e+00 1.762804e-02 276.97 -2.00 20.00 -2.00 320.99 0.00e+00 6.029 0.004 302.00 328.00 3 5.1572e-01 4.8644e-03 7.7394e-02 -6.0000e+00 9.7140e-01 3.0347e-01 7.1077e-03 5.3308e-02 -6.0000e+00 1.0574e+00 -3.6631e-01 7.7277e-03 2.5119e-02 -6.0000e+00 6.2689e-01 1.4468e-01 3.6035e-03 1.1988e-02 -6.0000e+00 2.6103e-01 3.2323e-04 -1.4381e-03 6.9760e-05 1.1978e-04 -6.0000e+00 1.9973e-02 -1.2155e-04 5.8802e-06 12 8 8 10 0 0 39.80 22.77 0.34 -0.00012 -0.01093 139 26 1 5 0 362.820 25.68 20.00 22.77 6.70 26.7 1033.52 -241270 -89633 900000 -296949 -132846 -195347 -238825 900000 -11840 -219627 -265118 -143247 -198001 -84364 900000 -64015 -170559 -86749 900000 128808 31768 44427 835 -77209 -33390 -36199 900000 -76453 -19275 -89091 -20761 -3671 -30187 -54216 -186 124090 -10589 -4534 26201 41861 -10994 21388 -11048 14610 -1934 52536 -778 32463 21726 21980 17564 4685 4275 19187 22647 8990 20562 8873 13006 8200 9107 13535 2081 -78 6227 4230 8071 3180 7495 7786 989 2407 4321 -1981 4150 -53 4437 3919 825 -1146 598 2769 -15 -132 -2352 -1008 -2355 -1521 -3385 90 -945 -890 742 885 -639 -138 -950 5 -521 -1310 -637 -1121 440 1115 187 -1340 -667 -713 -957 102 -804 -1218 -426 -425 -550 307 732 1200 466 56 -397 171 1020 526 494 267 621 1579 1092 -313 544 381 749 513 51 -235 -138 284 -472 -677 -189 5 -132 -479 -2130 -223 900000 -6407 -561 -1454 -2770 900000 -29 -2782 -5602 -1068 -3185 -609 900000 -640 -5592 -1471 900000 318 212 265 8 -1598 -491 -579 900000 -1861 -276 -2661 -384 -72 -918 -2322 -5 999 -319 -146 750 1239 -617 982 -733 804 -127 2150 -54 1741 1368 1502 1381 466 478 2054 2541 1208 2583 1259 1752 1127 1242 1860 355 -16 1308 959 1785 752 1825 2116 319 826 1495 -706 1315 -16 1180 1020 235 -381 231 1219 -8 -73 -1404 -629 -1559 -1040 -2385 61 -627 -564 444 527 -409 -99 -789 5 -549 -1483 -725 -1215 435 1021 171 -1293 -673 -753 -1081 124 -1097 -1814 -666 -678 -868 470 1094 1797 722 90 -653 277 1590 797 730 386 876 2186 1579 -502 958 729 1517 1085 113 -548 -333 695 -1167 -1671 -455 12 -290 -1024 SS 20210313T122248.5Z 7742.515839 75 1 50.93 2 77.17 105.09 82.98 106.21 0.00 1 0.00 1 0 25 2.143e-01 6.263e-03 2.839e-02 8.454e-04 6.348019e-01 4.471060e-04 7.264771e-03 -6.000000e+00 1.262455e-01 226.09 -2.00 3.51 -2.00 320.22 0.00e+00 2.232024e-03 1.591737e-04 1.067526e-03 -6.000000e+00 5.492083e-03 276.97 -2.00 20.00 -2.00 319.68 0.00e+00 4.386 0.001 302.00 328.00 3 3.7839e-01 1.3161e-03 5.5025e-02 -6.0000e+00 3.1276e-01 7.1131e-02 1.6470e-03 3.4291e-02 -6.0000e+00 3.3965e-01 -4.3969e-02 1.5746e-03 1.6919e-02 -6.0000e+00 2.0210e-01 7.0241e-03 8.0062e-04 5.8531e-03 -6.0000e+00 8.4712e-02 2.2238e-03 -8.5990e-04 2.4266e-05 6.3817e-05 -6.0000e+00 6.3890e-03 -4.6958e-04 -7.1852e-06 10 0 0 10 0 0 12.13 22.77 0.23 -0.00047 -0.00693 392 74 1 5 0 128.570 25.68 19.98 22.77 7.09 26.7 1035.23 -97638 -57004 -15512 -93000 -66900 -74553 -79122 -52035 -60334 -75012 -69022 -45881 -47217 -27230 -5181 -20586 -35165 -11701 -4778 -1812 -6680 -956 -9177 -10796 -11388 -10679 328 -12661 -12566 -14674 -4328 -1933 -4160 -8077 -1366 2250 -1554 -3002 944 944 -2482 -1803 -2892 -1107 -1650 2553 -1213 1575 500 2079 1862 1373 920 2077 2252 1095 1679 18 884 331 1635 2024 1865 906 200 614 1712 1244 2072 1478 17 -42 -468 -681 -576 -213 754 945 979 245 48 -532 -1449 -1173 -1386 -1236 -1054 -634 -622 -616 -139 638 697 1496 1274 1080 698 715 -359 -604 -334 -235 313 956 -79 -918 -411 -719 -152 -5 -273 -517 -304 -108 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