File name: Pandora55s1_QueensNY_20210507_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T184556.6Z 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_20210507_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: 20210507 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 20210507T103913.5Z 7797.443906 101 1 50.91 2 81.36 75.04 65.27 122.30 0.00 1 0.00 1 0 25 6.634e-01 2.130e-02 1.998e-01 3.384e-03 9.644147e-01 1.994765e-03 1.051034e-02 -6.000000e+00 4.054362e-01 230.43 -2.00 3.51 -2.00 321.82 0.00e+00 6.188906e-03 1.147632e-03 3.458712e-03 -6.000000e+00 1.851200e-02 282.76 -2.00 20.00 -2.00 321.34 0.00e+00 6.280 0.004 302.00 328.00 3 5.3303e-01 7.5236e-03 8.6518e-02 -6.0000e+00 1.0162e+00 6.2864e-01 1.1161e-02 6.6821e-02 -6.0000e+00 1.1045e+00 -8.2585e-01 1.1269e-02 2.9360e-02 -6.0000e+00 6.5209e-01 3.3679e-01 5.0606e-03 1.2921e-02 -6.0000e+00 2.6918e-01 2.0368e-04 -2.0217e-03 8.9522e-05 1.4081e-04 -6.0000e+00 2.0334e-02 1.6385e-03 3.0361e-05 12 8 8 10 0 0 98.19 22.86 0.31 0.00164 -0.01355 110 21 1 5 0 458.490 25.79 20.00 22.86 15.60 28.1 1058.99 -207550 30921 900000 -264526 -106704 -26992 -264232 900000 -218240 -142127 -268685 -112166 -254036 -83849 900000 -63192 -154543 -37894 900000 145510 900000 -35489 900000 -76811 -60587 -61576 900000 -82667 -58663 -108120 -37631 57069 28861 -42161 -9269 900000 -36167 19210 53892 103273 19776 39330 8907 23703 42473 76583 11044 64962 73534 37968 22047 7480 22080 49103 47096 36944 46399 41285 36239 24981 6938 34419 8607 8651 18677 2938 21977 1144 21583 13348 8094 5476 12113 470 15571 2820 5533 12244 1961 564 261 6885 28 2990 -3112 -82 -3725 -438 -2742 -612 -2216 -713 1087 -1194 1020 -1100 -1899 -1923 -2111 -3407 -1283 -1772 114 1571 -952 -2012 -2267 -705 -759 506 -1493 -2098 -740 -759 -447 -270 1211 1314 623 -97 -394 461 1836 1617 974 634 1030 2066 589 -297 402 882 924 1094 602 -82 -101 375 -657 -887 -542 -272 -80 -914 -2048 102 900000 -5979 -488 -89 -5153 900000 -3169 -1046 -7065 -739 -8207 -706 900000 -720 -4954 -452 900000 480 900000 -478 900000 -1597 -1147 -1231 900000 -2011 -1138 -3568 -755 580 467 -1502 -249 900000 -1238 433 1038 1479 715 1306 416 1001 1528 2043 558 2072 2320 1819 1354 592 1712 3265 3444 3132 3747 3522 3173 2340 754 3037 1073 1237 2741 531 3419 222 3732 2798 1990 1489 3168 132 3544 654 1147 2331 440 149 83 2407 12 1344 -1572 -43 -2097 -249 -1614 -349 -1239 -376 541 -611 550 -692 -1404 -1644 -2039 -3599 -1346 -1774 103 1291 -787 -1746 -2074 -670 -775 565 -1904 -2973 -1112 -1174 -688 -407 1768 1935 951 -155 -640 731 2768 2349 1386 885 1397 2760 836 -471 713 1706 1910 2384 1387 -198 -254 956 -1693 -2280 -1351 -643 -179 -1984 SS 20210507T110201.4Z 7797.459739 114 1 50.87 2 77.16 78.57 61.73 127.09 0.00 1 0.00 1 0 25 3.403e-01 6.970e-03 4.588e-02 8.925e-04 7.092457e-01 4.840312e-04 8.053609e-03 -6.000000e+00 2.038057e-01 230.43 -2.00 3.51 -2.00 320.52 0.00e+00 2.929212e-03 1.949921e-04 1.356355e-03 -6.000000e+00 8.933939e-03 282.76 -2.00 20.00 -2.00 319.92 0.00e+00 4.378 0.001 302.00 328.00 3 3.2258e-01 1.4870e-03 5.8572e-02 -6.0000e+00 5.0913e-01 9.4890e-02 1.9316e-03 3.9751e-02 -6.0000e+00 5.5060e-01 -6.5029e-02 1.8807e-03 1.9170e-02 -6.0000e+00 3.2762e-01 1.4778e-02 9.3076e-04 7.4394e-03 -6.0000e+00 1.3688e-01 2.0932e-03 -1.0068e-03 2.4730e-05 7.0094e-05 -6.0000e+00 1.0161e-02 8.1390e-04 3.9576e-05 11 8 0 10 0 0 19.32 22.87 0.24 0.00081 -0.00675 390 74 1 5 0 129.090 25.79 20.00 22.87 17.20 28.2 1067.21 -144453 -92631 6440 -147729 -110619 -127831 -128701 -65303 -85856 -96391 -112354 -83869 -93568 -56449 -23801 -31349 -53780 -28980 -8955 -3840 -22477 -16791 -10259 -20911 -20278 -24559 1886 -24152 -14983 -24909 -9354 -7727 -3126 -11777 -4445 5796 -6044 -2691 588 1880 -3403 -1398 -3302 -594 -503 2484 -980 2281 2013 1617 1496 806 1757 3465 2735 1244 2387 -142 1340 523 1262 2524 1639 1631 1060 1000 2387 1235 2572 1687 157 -185 -240 -513 -69 -318 471 957 1298 201 63 -249 -1353 -1350 -1447 -1213 -1154 -706 -665 -304 -90 594 670 1438 1184 815 575 674 -339 -602 -347 -304 359 1005 -53 -1327 -677 -836 -13 -124 -242 -569 -293 58 108 609 893 836 445 -375 -861 -346 3 -232 133 -103 437 1416 1006 59 316 36 356 234 203 -339 -220 184 -413 -488 -180 -85 -17 270 -1144 -540 16 -1578 -867 -1157 -1232 -375 -695 -965 -1438 -913 -1385 -752 -296 -524 -1209 -578 -162 -71 -530 -384 -227 -554 -587 -803 49 -822 -466 -899 -331 -327 -151 -699 -254 297 -363 -179 42 163 -363 -163 -422 -77 -67 330 -139 324 302 261 265 149 361 771 663 325 643 -40 369 142 341 710 519 586 394 388 908 478 1042 775 83 -99 -133 -279 -37 -157 211 407 575 102 35 -164 -957 -1044 -1196 -1002 -1010 -644 -619 -279 -79 517 549 1142 989 724 593 758 -413 -791 -456 -374 418 1079 -57 -1540 -826 -1024 -17 -169 -352 -914 -475 95 171 956 1348 1265 702 -600 -1425 -566 4 -366 202 -159 642 2014 1494 94 540 64 685 457 421 -724 -475 407 -928 -1091 -389 -179 -35 536 SS 20210507T110812.4Z 7797.464033 117 1 50.88 2 76.00 79.53 60.81 128.46 0.00 1 0.00 1 0 25 2.353e-01 6.580e-03 2.347e-02 7.099e-04 6.589140e-01 3.813280e-04 7.519763e-03 -6.000000e+00 1.409425e-01 230.43 -2.00 3.51 -2.00 320.21 0.00e+00 2.549672e-03 1.388480e-04 9.684730e-04 -6.000000e+00 6.177954e-03 282.76 -2.00 20.00 -2.00 319.59 0.00e+00 4.042 0.001 302.00 328.00 3 2.9151e-01 1.1375e-03 5.3909e-02 -6.0000e+00 3.5209e-01 8.0590e-02 1.4241e-03 3.6061e-02 -6.0000e+00 3.8076e-01 -5.1068e-02 1.3163e-03 1.7542e-02 -6.0000e+00 2.2657e-01 9.9684e-03 6.6421e-04 6.3673e-03 -6.0000e+00 9.4662e-02 3.1401e-03 -9.3629e-04 1.9989e-05 6.4438e-05 -6.0000e+00 7.0265e-03 5.2939e-04 4.3892e-05 11 8 0 10 0 0 5.06 22.87 0.21 0.00053 -0.00651 482 91 1 5 0 104.460 25.79 19.99 22.87 17.31 28.1 1067.73 -101766 -70109 -37814 -103491 -68737 -87446 -69135 -72379 -62174 -70835 -70262 -60203 -60514 -41452 -16179 -16384 -27600 -20356 -4182 -1665 -12873 -7591 -9466 -10055 -9562 -14157 -3592 -15634 -8485 -16098 -3483 -4581 841 -6876 -2055 2234 -6027 -1366 -780 -130 -3212 -865 -2217 170 -873 1556 -1053 1086 1432 1430 1498 1372 1838 2064 1994 1159 1599 -63 938 124 1455 2151 1690 1494 433 965 1274 1361 1830 1509 -39 -258 -429 -580 -370 -417 323 806 1043 157 354 -442 -1392 -1482 -1300 -1052 -1102 -588 -611 -424 -30 691 633 1344 1326 1053 618 759 -340 -651 -353 -476 306 995 -83 -1201 -556 -825 -98 -28 -232 -471 -254 -79 18 784 999 916 415 -415 -834 -327 -130 -314 48 -29 466 1387 981 141 290 -53 325 118 256 -299 -231 183 -474 -438 -236 1 30 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