File name: Pandora55s1_QueensNY_20220131_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T112956.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c19p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v19d20211111.txt Level 1 file used: Pandora55s1_QueensNY_20220131_L1_smca1c19d20211111p1-8.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: 20220131 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]: 305.0379 305.1778 305.3178 305.4578 305.5977 305.7376 305.8776 306.0175 306.1574 306.2973 306.4372 306.5770 306.7169 306.8567 306.9966 307.1364 307.2762 307.4160 307.5558 307.6956 307.8354 307.9752 308.1149 308.2547 308.3944 308.5341 308.6738 308.8135 308.9532 309.0929 309.2326 309.3723 309.5119 309.6515 309.7912 309.9308 310.0704 310.2100 310.3496 310.4892 310.6287 310.7683 310.9079 311.0474 311.1869 311.3264 311.4659 311.6054 311.7449 311.8844 312.0239 312.1633 312.3028 312.4422 312.5816 312.7210 312.8604 312.9998 313.1392 313.2786 313.4179 313.5573 313.6966 313.8360 313.9753 314.1146 314.2539 314.3932 314.5324 314.6717 314.8110 314.9502 315.0895 315.2287 315.3679 315.5071 315.6463 315.7855 315.9246 316.0638 316.2030 316.3421 316.4812 316.6204 316.7595 316.8986 317.0377 317.1767 317.3158 317.4549 317.5939 317.7329 317.8720 318.0110 318.1500 318.2890 318.4280 318.5669 318.7059 318.8449 318.9838 319.1227 319.2617 319.4006 319.5395 319.6784 319.8172 319.9561 320.0950 320.2338 320.3726 320.5115 320.6503 320.7891 320.9279 321.0667 321.2054 321.3442 321.4830 321.6217 321.7604 321.8991 322.0379 322.1766 322.3152 322.4539 322.5926 322.7312 322.8699 323.0085 323.1471 323.2857 323.4243 323.5629 323.7015 323.8401 323.9786 324.1172 324.2557 324.3943 324.5328 324.6713 324.8098 324.9483 --------------------------------------------------------------------------------------- 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 20220131T125826.4Z 8066.540583 70 1 49.91 2 82.00 121.15 82.87 131.82 0.00 1 0.00 1 0 25 6.730e-01 2.392e-02 2.148e-01 3.994e-03 9.136317e-01 2.329766e-03 1.024618e-02 -6.000000e+00 4.026118e-01 224.35 -2.00 3.51 -2.00 321.85 0.00e+00 8.703104e-03 1.270877e-03 7.593615e-03 -6.000000e+00 1.994516e-02 275.29 -2.00 20.00 -2.00 321.42 0.00e+00 6.722 0.005 302.00 328.00 3 4.3499e-01 8.3329e-03 9.4954e-02 -6.0000e+00 9.9595e-01 6.0210e-01 1.2524e-02 8.1517e-02 -6.0000e+00 1.0912e+00 -8.0420e-01 1.3401e-02 3.2251e-02 -6.0000e+00 6.4283e-01 3.2990e-01 6.1075e-03 1.0534e-02 -6.0000e+00 2.6803e-01 1.6720e-04 -3.3935e-03 1.1056e-04 1.3825e-04 -6.0000e+00 2.0794e-02 5.2184e-03 -1.7774e-04 12 8 8 10 0 0 60.82 22.68 0.33 0.00522 -0.02028 92 17 1 5 0 542.370 25.58 20.00 22.68 0.69 28.9 1024.66 -169279 900000 900000 -270695 900000 900000 -127209 900000 -15371 -120530 -252201 -150841 -198468 -236845 900000 54627 -125769 -32895 900000 900000 900000 97 900000 -29731 35412 -47896 900000 7134 -54888 -102067 40904 125674 93100 -35816 81201 900000 17771 26271 197481 175370 2208 87038 5122 49144 40501 229770 -1484 61404 79026 65769 48899 31071 29317 64313 77095 27698 63454 33975 56188 20800 26491 44149 21039 4597 27531 7276 24805 10210 10523 12781 5904 6619 12185 4154 17440 4347 10510 15027 7131 3152 -3763 7585 3965 1391 -7264 -3356 -2996 -2174 -3994 4 -1932 -616 1635 -602 -1479 -945 -3124 -2375 -1518 -3066 -1636 -823 -41 659 253 -2002 -932 -1300 -1275 954 -958 -2851 -748 -738 -927 480 981 1966 -76 24 -920 639 1782 2024 1192 888 833 2191 253 -506 1204 678 1328 889 550 -286 170 372 -659 -714 -551 -309 -394 -1030 -1530 900000 900000 -8125 900000 900000 -819 900000 -60 -855 -6716 -1730 -4587 -10513 900000 239 -3674 -444 900000 900000 900000 1 900000 -446 296 -922 900000 80 -1130 -3563 440 741 907 -1316 991 900000 398 607 1032 1340 100 1941 260 1721 1562 1477 -89 2159 2522 2587 2489 2092 2230 3866 4397 2609 4425 3111 4088 2034 2445 3665 2435 708 3837 1287 3804 1848 2042 2725 1493 1780 3153 1111 3821 977 2054 2779 1544 825 -1253 2648 1616 631 -3777 -1776 -1657 -1237 -2338 2 -1058 -316 795 -303 -811 -593 -2320 -2030 -1445 -3173 -1678 -791 -36 528 204 -1714 -831 -1229 -1299 1059 -1215 -4040 -1110 -1121 -1393 698 1398 2814 -114 38 -1464 988 2619 2871 1658 1210 1113 2880 357 -803 2117 1303 2712 1918 1253 -689 422 935 -1677 -1803 -1347 -719 -866 -2214 SS 20220131T131638.9Z 8066.553229 76 1 48.29 2 79.10 124.43 80.44 135.02 0.00 1 0.00 1 0 25 4.015e-01 7.414e-03 6.787e-02 1.301e-03 7.275881e-01 7.015655e-04 8.362707e-03 -6.000000e+00 2.358107e-01 224.35 -2.00 3.51 -2.00 320.85 0.00e+00 3.914352e-03 2.998059e-04 2.547134e-03 -6.000000e+00 1.034463e-02 275.29 -2.00 20.00 -2.00 320.36 0.00e+00 5.095 0.002 302.00 328.00 3 2.5307e-01 2.1755e-03 6.4786e-02 -6.0000e+00 5.8299e-01 8.3235e-02 2.9474e-03 4.2967e-02 -6.0000e+00 6.3526e-01 -5.9933e-02 3.1573e-03 2.0170e-02 -6.0000e+00 3.7663e-01 1.2998e-02 1.5446e-03 7.1753e-03 -6.0000e+00 1.5753e-01 1.1913e-03 -2.3119e-03 3.6386e-05 8.3085e-05 -6.0000e+00 1.2179e-02 3.8505e-03 -1.3497e-04 11 8 0 10 0 0 59.14 22.69 0.26 0.00385 -0.01352 261 49 1 5 0 184.970 25.58 19.99 22.69 2.08 29.2 1024.74 -156875 -87491 900000 -197939 -102031 -133273 -112519 900000 -117713 -112459 -141165 -103535 -129458 -128576 23619 -38090 -56642 -47606 5001 -1555 -16467 -23613 -9647 -33376 -30567 -28071 19789 -19770 -25018 -34890 -3528 -5426 -5068 -18743 -6145 13638 -2775 -5982 3304 2444 -5489 2335 -6107 -996 -535 5903 -3779 3168 2469 4921 2866 1484 2303 4160 4889 443 2783 207 1152 -567 1534 3957 2777 651 1575 831 1809 972 2076 1600 349 102 327 -820 308 -362 809 1711 1675 348 -21 72 -1042 -1251 -1743 -1094 -1578 -788 -996 -373 -126 684 835 1250 1097 1328 481 531 -341 -571 -318 -320 494 927 -362 -1229 -620 -867 -181 56 -218 -578 -221 -14 -76 797 1012 991 313 -426 -844 -278 -23 8 117 -117 496 1464 725 -92 274 -30 387 299 171 -412 -209 106 -498 -490 -137 153 146 158 -886 -303 900000 -2351 -492 -784 -628 900000 -814 -817 -1497 -871 -1791 -2342 135 -457 -966 -845 58 -21 -268 -422 -156 -739 -722 -696 315 -470 -635 -1050 -91 -176 -196 -927 -275 498 -126 -326 184 166 -470 205 -627 -102 -56 596 -436 356 297 623 409 243 387 756 952 95 610 47 257 -126 337 906 726 198 525 290 625 344 724 634 158 50 163 -402 139 -149 302 662 640 156 -11 42 -690 -906 -1269 -842 -1291 -668 -860 -316 -102 549 634 935 877 1128 451 578 -398 -716 -395 -370 541 941 -375 -1359 -721 -1012 -226 73 -323 -898 -361 -23 -121 1202 1554 1534 484 -695 -1418 -457 -36 12 180 -173 706 2032 1069 -146 466 -57 742 609 355 -916 -466 240 -1151 -1125 -302 330 308 324 SS 20220131T132236.1Z 8066.557362 79 1 48.97 2 78.17 125.53 79.67 136.10 0.00 1 0.00 1 0 25 3.167e-01 8.098e-03 5.870e-02 1.418e-03 6.780439e-01 7.571157e-04 7.833150e-03 -6.000000e+00 1.859949e-01 224.35 -2.00 3.51 -2.00 320.58 0.00e+00 3.126587e-03 2.989455e-04 1.892156e-03 -6.000000e+00 8.158739e-03 275.29 -2.00 20.00 -2.00 320.08 0.00e+00 4.728 0.002 302.00 328.00 3 8.5433e-01 2.2827e-03 5.9484e-02 -6.0000e+00 4.5983e-01 8.2289e-02 2.9658e-03 3.8150e-02 -6.0000e+00 5.0104e-01 -5.8406e-02 3.0149e-03 1.8409e-02 -6.0000e+00 2.9706e-01 1.2760e-02 1.5030e-03 6.1066e-03 -6.0000e+00 1.2426e-01 9.6813e-04 -2.1795e-03 4.0275e-05 7.2358e-05 -6.0000e+00 9.6051e-03 3.6344e-03 -1.1966e-04 11 8 0 10 0 0 75.10 22.68 0.21 0.00363 -0.01274 182 34 1 5 0 269.030 25.58 20.01 22.68 2.39 29.1 1024.64 -89386 -67266 900000 -162001 -57714 -86584 -134592 900000 -82243 -41688 -138099 -52679 -114942 -104732 17662 -31247 -49390 -54589 23947 1745 2680 -24528 2652 -31770 -14683 -28813 25843 -20534 -18904 -27019 -9504 7588 -5395 -13941 -6856 14284 -10113 -666 2978 5077 -4912 -526 -4156 -498 2080 3547 -1344 1016 3437 3415 2245 1588 1789 5150 4504 2338 2218 1599 2195 1364 1174 4212 1940 449 2266 365 2575 909 2149 1040 -208 -991 375 -1017 497 -950 1016 2027 870 791 -507 -41 -1391 -1294 -1652 -1234 -1661 -881 -822 -350 144 168 995 1027 1147 1033 584 478 -191 -510 -105 -407 257 980 -646 -1125 -896 -679 -103 214 -87 -610 -121 -48 58 783 1054 732 253 -488 -856 -542 -22 -110 282 258 592 1526 536 110 275 41 405 278 131 -375 -163 162 -460 -490 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