File name: Pandora180s1_BronxNY_20211025_L2Fit_fout2c2d20210302p1-8.txt File generation date: 20260323T073009.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 180 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora180_OF_v2d20201002.txt Instrument calibration file used: Pandora180s1_CF_v2d20210302.txt Level 1 file used: Pandora180s1_BronxNY_20211025_L1_smca1c2d20210302p1-8.txt Full location name: New York Botanical Garden NYSDEC (USEPA AQS ID 36-005-0133) Short location name: BronxNY Country of location: USA Location latitude [deg]: 40.8679 Location longitude [deg]: -73.8781 Location altitude [m]: 31 Local noon date: 20211025 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0771 305.2181 305.3590 305.5000 305.6409 305.7819 305.9228 306.0637 306.2046 306.3455 306.4864 306.6273 306.7681 306.9090 307.0498 307.1906 307.3315 307.4723 307.6131 307.7539 307.8946 308.0354 308.1762 308.3169 308.4577 308.5984 308.7391 308.8798 309.0205 309.1612 309.3019 309.4425 309.5832 309.7238 309.8644 310.0051 310.1457 310.2863 310.4269 310.5674 310.7080 310.8486 310.9891 311.1297 311.2702 311.4107 311.5512 311.6917 311.8322 311.9726 312.1131 312.2536 312.3940 312.5344 312.6749 312.8153 312.9557 313.0961 313.2364 313.3768 313.5172 313.6575 313.7978 313.9382 314.0785 314.2188 314.3591 314.4994 314.6396 314.7799 314.9201 315.0604 315.2006 315.3408 315.4810 315.6212 315.7614 315.9016 316.0418 316.1819 316.3221 316.4622 316.6023 316.7424 316.8825 317.0226 317.1627 317.3028 317.4428 317.5829 317.7229 317.8629 318.0029 318.1430 318.2829 318.4229 318.5629 318.7029 318.8428 318.9828 319.1227 319.2626 319.4025 319.5424 319.6823 319.8222 319.9620 320.1019 320.2417 320.3816 320.5214 320.6612 320.8010 320.9408 321.0806 321.2203 321.3601 321.4998 321.6396 321.7793 321.9190 322.0587 322.1984 322.3381 322.4778 322.6174 322.7571 322.8967 323.0363 323.1760 323.3156 323.4552 323.5947 323.7343 323.8739 324.0134 324.1530 324.2925 324.4320 324.5715 324.7110 324.8505 324.9900 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20211025T125708.6Z 7968.539683 318 1 30.85 2 73.85 122.92 58.97 277.68 0.00 1 0.00 1 0 17 1.956e-01 1.297e-02 2.053e-01 9.858e-03 4.018150e-01 5.091846e-03 4.938696e-03 -6.000000e+00 1.133287e-01 225.07 -2.00 3.51 -2.00 319.69 0.00e+00 5.169185e-04 1.498587e-03 1.651467e-03 -6.000000e+00 5.019460e-03 282.98 -2.00 20.00 -2.00 319.03 0.00e+00 3.535 0.001 302.00 328.00 3 5.2963e+00 1.4490e-02 4.1295e-02 -6.0000e+00 2.7979e-01 6.2206e-02 1.7246e-02 2.2973e-02 -6.0000e+00 3.0315e-01 -3.1230e-02 1.3943e-02 1.0997e-02 -6.0000e+00 1.8095e-01 8.6014e-03 7.3257e-03 3.0190e-03 -6.0000e+00 7.8352e-02 4.9030e-05 -7.7017e-05 3.0085e-04 3.9617e-05 -6.0000e+00 5.4981e-03 1.8381e-02 1.2301e-04 12 8 8 10 0 0 99.60 24.02 0.35 0.01838 0.01780 8 8 1 5 0 3855.260 27.99 19.99 24.02 24.86 21.7 989.84 26357 119063 121629 5127 51880 -89422 31198 -11951 -8018 60094 21556 -18059 -13476 -16083 1952 15445 24420 12850 13347 -28200 389 -15948 -19669 26692 12829 -10737 -4811 -22336 -7755 -20281 -10328 -4865 1508 -2256 -8111 -2062 872 1590 1052 4603 2431 2447 3446 6389 3834 1071 5356 -192 1602 644 5393 1909 2078 -3686 -1518 -7888 2665 -1120 2214 1538 -1130 1231 2081 3529 1806 -2887 -1026 1188 155 2902 2478 3010 2443 694 -2273 -1808 -4289 -3608 1262 998 -1616 -2713 -1494 -2246 1456 -489 1073 831 1742 2845 -559 -1725 -2283 -1652 -661 -1000 1101 804 430 -768 -1260 -1300 -2057 -2230 -1692 -1221 -527 221 599 1107 1352 679 771 800 -778 -606 -456 -112 -41 -612 635 863 1240 571 1055 -149 -503 123 -556 499 -686 -514 -437 946 -567 836 299 428 114 -905 100 -912 900000 369 1144 1169 94 544 -3829 436 -292 -210 840 452 -615 -518 -759 90 702 1088 685 746 -2489 26 -1268 -1702 1719 1011 -1013 -467 -2448 -708 -2183 -1122 -561 180 -284 -1029 -250 115 248 199 978 577 612 881 1603 991 286 1364 -52 428 181 1571 626 729 -1456 -610 -3480 1076 -465 870 609 -481 560 1034 1849 956 -1509 -507 585 85 1752 1624 2022 1623 445 -1372 -979 -2214 -1852 680 619 -1166 -2193 -1275 -2045 1370 -500 1130 896 1842 2827 -532 -1532 -1933 -1420 -616 -1056 1282 1039 581 -1021 -1562 -1477 -2266 -2578 -2093 -1582 -715 315 915 1656 2136 1092 1195 1276 -1176 -881 -673 -174 -68 -1057 1083 1430 1984 880 1545 -211 -698 178 -884 850 -1252 -969 -776 1749 -1129 1708 627 912 240 -1859 194 -1722 900000 SS 20211025T130325.9Z 7968.544050 322 1 29.07 2 72.86 124.15 60.11 278.58 0.00 1 0.00 1 0 17 9.238e-02 1.035e-02 6.045e-02 5.560e-03 3.775658e-01 2.882840e-03 4.622561e-03 -6.000000e+00 5.348657e-02 225.07 -2.00 3.51 -2.00 319.42 0.00e+00 8.650236e-04 7.632202e-04 1.233721e-03 -6.000000e+00 2.370655e-03 282.98 -2.00 20.00 -2.00 318.72 0.00e+00 3.343 0.001 302.00 328.00 3 4.6824e+00 8.1169e-03 3.8760e-02 -6.0000e+00 1.3205e-01 3.5707e-02 9.4810e-03 2.0658e-02 -6.0000e+00 1.4310e-01 -1.3358e-02 7.1406e-03 1.0129e-02 -6.0000e+00 8.5410e-02 -4.9248e-03 3.7416e-03 2.8504e-03 -6.0000e+00 3.6966e-02 1.1389e-04 -2.6186e-04 1.7114e-04 3.6492e-05 -6.0000e+00 2.5968e-03 1.9721e-02 3.8709e-05 12 9 8 11 8 0 99.81 24.02 0.42 0.01972 0.01775 13 13 1 5 0 2235.950 27.88 20.00 24.02 24.97 21.8 990.99 -3785 -16824 -57874 -24747 -15998 -31086 -3863 -47475 -8931 -24812 27984 -22715 13978 -20968 13050 2695 -10954 -1468 -2865 7785 -6497 6889 -2148 3707 1020 713 3901 -7658 4114 -2978 6433 -4846 4874 -2806 -12384 -2569 -6951 4041 -4982 1168 1744 758 -763 1752 296 -2381 112 -904 5140 -404 121 1794 1155 -111 383 2359 -277 1141 -1070 2029 3024 3125 5768 1574 -139 -153 1459 -120 2797 954 2490 475 974 -606 -1590 -562 -1454 -2502 -3923 -2209 -1827 -2849 -2037 -1617 -316 292 48 1503 762 350 917 -1805 -796 -1473 -1975 702 209 1017 439 364 -797 -315 -1461 -2160 -1252 -503 -378 1 445 1157 1403 581 -142 -150 -502 -58 130 575 468 -441 186 36 1253 510 662 -433 150 -7 319 344 -776 -780 -422 281 -517 634 374 335 416 -638 -86 -508 900000 -88 -489 -2596 -744 -402 -904 -93 -2012 -315 -1076 728 -1071 538 -1364 707 181 -903 -117 -244 620 -606 564 -201 352 106 77 404 -843 388 -313 684 -644 645 -406 -1873 -358 -1134 703 -1145 292 474 219 -231 523 90 -747 34 -277 1494 -129 42 659 456 -47 168 1042 -128 513 -483 890 1377 1554 3071 931 -83 -86 770 -65 1634 641 1780 357 716 -429 -1041 -328 -796 -1384 -2418 -1534 -1430 -2490 -1884 -1433 -297 291 50 1580 798 350 926 -1726 -713 -1354 -1997 777 237 1268 573 461 -946 -341 -1705 -2424 -1498 -629 -498 2 659 1838 2347 986 -234 -231 -722 -80 183 847 737 -729 306 58 1933 757 937 -593 199 -9 483 563 -1355 -1408 -787 548 -1079 1248 756 689 845 -1379 -177 -1013 900000 SS 20211025T130847.2Z 7968.547768 325 1 29.91 2 72.03 125.21 61.08 279.35 0.00 1 0.00 1 0 25 4.440e-02 6.345e-03 2.277e-02 2.479e-03 3.654968e-01 1.277399e-03 4.401641e-03 -6.000000e+00 2.569509e-02 225.07 -2.00 3.51 -2.00 319.15 0.00e+00 1.146135e-03 3.112097e-04 6.168832e-04 -6.000000e+00 1.139439e-03 282.98 -2.00 20.00 -2.00 318.45 0.00e+00 3.198 0.001 302.00 328.00 3 3.6271e+00 3.5358e-03 3.6920e-02 -6.0000e+00 6.3436e-02 1.2283e-02 4.0961e-03 1.9061e-02 -6.0000e+00 6.8751e-02 -2.1594e-03 3.0122e-03 9.5768e-03 -6.0000e+00 4.1035e-02 -7.5869e-03 1.5921e-03 2.8533e-03 -6.0000e+00 1.7754e-02 3.8462e-04 -4.7053e-04 7.5213e-05 3.3703e-05 -6.0000e+00 1.2482e-03 2.0327e-02 -3.8663e-05 10 0 0 10 0 0 95.52 24.02 0.34 0.02033 0.01679 35 35 1 5 0 854.360 27.88 19.99 24.02 25.10 21.8 991.74 -5496 -19713 -8514 -13484 -26704 -7336 -20575 2226 -10051 -13198 -10554 -6046 -8586 -4047 4642 3022 5617 -5057 319 -1525 -1091 -735 466 -2541 -2505 784 -5893 -885 -4258 351 612 -1672 798 -1710 -3459 -3547 -695 -1652 1235 -803 -709 -1027 -979 200 1700 148 -991 -505 -2546 532 -392 1633 1767 1248 1647 612 1221 122 1133 857 606 1638 2375 2079 491 1216 -1437 115 853 1676 1345 736 1335 -258 -520 -610 -1510 -1317 -1327 -793 -1370 -1292 -2235 -1271 -1020 -197 114 681 942 458 798 -707 -451 -358 -144 -332 828 710 -124 -168 -959 -1065 -787 -916 -676 -959 -526 -179 199 473 835 399 435 -116 -394 169 -59 357 161 -1 274 365 366 458 336 82 331 -126 607 -29 64 -395 -154 -47 -14 34 155 119 -63 -25 -461 -394 900000 -153 -698 -303 -469 -968 -218 -761 74 -420 -597 -472 -282 -484 -259 319 235 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