File name: Pandora69s1_NewBrunswickNJ_20231225_L2Fit_fout2c23d20210421p1-8.txt File generation date: 20240123T195811.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c23p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 69 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora69_OF_v2d20210223.txt Instrument calibration file used: Pandora69s1_CF_v23d20210421.txt Level 1 file used: Pandora69s1_NewBrunswickNJ_20231225_L1_smca1c23d20210421p1-8.txt Full location name: Rutgers NJDEP (USEPA AQS ID 34-023-0011) Short location name: NewBrunswickNJ Country of location: USA Location latitude [deg]: 40.4622 Location longitude [deg]: -74.4294 Location altitude [m]: 19 Local noon date: 20231225 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: based on s13, field cal for NewBrunswick, revisited HCHO First and last pixel inside fitting window: 259 400 Nominal wavelengths inside fitting window [nm]: 305.1248 305.2657 305.4066 305.5475 305.6883 305.8292 305.9700 306.1109 306.2517 306.3925 306.5333 306.6741 306.8148 306.9556 307.0963 307.2371 307.3778 307.5185 307.6592 307.7999 307.9406 308.0812 308.2219 308.3625 308.5032 308.6438 308.7844 308.9250 309.0656 309.2062 309.3467 309.4873 309.6278 309.7683 309.9089 310.0494 310.1898 310.3303 310.4708 310.6113 310.7517 310.8921 311.0326 311.1730 311.3134 311.4537 311.5941 311.7345 311.8748 312.0152 312.1555 312.2958 312.4361 312.5764 312.7167 312.8570 312.9972 313.1375 313.2777 313.4179 313.5581 313.6983 313.8385 313.9787 314.1189 314.2590 314.3991 314.5393 314.6794 314.8195 314.9596 315.0997 315.2397 315.3798 315.5198 315.6599 315.7999 315.9399 316.0799 316.2199 316.3598 316.4998 316.6397 316.7797 316.9196 317.0595 317.1994 317.3393 317.4792 317.6190 317.7589 317.8987 318.0386 318.1784 318.3182 318.4580 318.5978 318.7375 318.8773 319.0170 319.1568 319.2965 319.4362 319.5759 319.7156 319.8552 319.9949 320.1345 320.2742 320.4138 320.5534 320.6930 320.8326 320.9722 321.1117 321.2513 321.3908 321.5303 321.6698 321.8093 321.9488 322.0883 322.2278 322.3672 322.5067 322.6461 322.7855 322.9249 323.0643 323.2037 323.3430 323.4824 323.6217 323.7611 323.9004 324.0397 324.1790 324.3183 324.4575 324.5968 324.7360 324.8753 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20231225T130621.9Z 8759.546086 288 1 50.94 2 83.45 128.55 104.93 325.28 0.00 1 0.00 1 0 17 7.620e-01 5.099e-02 4.592e-01 3.896e-02 1.022484e+00 2.380706e-02 1.119758e-02 -6.000000e+00 4.502032e-01 223.16 -2.00 3.50 -2.00 322.13 0.00e+00 -1.269039e-02 8.666571e-03 1.070801e-03 -6.000000e+00 2.091848e-02 276.89 -2.00 20.00 -2.00 321.76 0.00e+00 7.960 0.009 302.00 328.00 3 1.1244e+00 7.5037e-02 9.5011e-02 -6.0000e+00 1.1169e+00 1.8775e+00 8.7046e-02 5.1418e-02 -6.0000e+00 1.2248e+00 -2.1733e+00 6.4418e-02 2.7464e-02 -6.0000e+00 7.2035e-01 8.1000e-01 3.6741e-02 9.3031e-03 -6.0000e+00 3.0505e-01 1.8035e-05 -1.3783e-03 1.1182e-03 1.4642e-04 -6.0000e+00 2.2812e-02 2.2161e-02 3.1890e-05 12 8 8 10 0 0 26.66 22.72 1.42 0.02216 0.01180 14 3 1 5 0 3637.400 25.90 20.00 22.72 12.23 28.9 961.53 172852 276530 900000 18017 -20116 -82816 900000 -55534 140212 900000 105409 -24241 125599 900000 109348 900000 -11691 900000 900000 118680 -47860 117118 208563 3682 900000 52764 900000 -77142 900000 -3233 53003 36251 11104 156889 58436 900000 315337 123338 -9803 900000 64970 900000 74628 40302 -4380 746 900000 48952 112655 1988 131693 29872 30818 3238 54671 390043 35271 54159 -41531 201636 50379 33127 -14943 123717 69533 10334 28492 -8138 64312 15955 104944 -19631 5569 38469 48256 6901 -9777 23697 -20739 21763 21155 1034 9414 -8513 781 7418 453 6986 14977 -8039 28978 -18524 16226 12327 -13728 -1367 -6930 7812 -3800 -4632 -6345 4102 -4680 -263 1758 -6715 -686 -6068 79 -5770 -1674 1247 2573 -2710 -2284 2978 -3952 4540 -2487 3312 -2329 5744 1285 6689 3358 -1025 4696 -2735 4974 88 4097 -4179 -634 338 1606 675 -324 221 -709 2376 -2788 -2393 6548 10475 900000 1024 -1397 -10457 900000 -5960 5311 900000 3993 -2143 4758 900000 4142 900000 -1292 900000 900000 4496 -5741 4437 7900 317 900000 2726 900000 -9984 900000 -223 2373 2122 879 5943 2415 900000 11945 4672 -1215 900000 4475 900000 4369 3053 -483 74 900000 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3.3018e-02 2.8497e-02 -6.0000e+00 5.4436e-01 5.1623e-01 1.6344e-02 1.0191e-02 -6.0000e+00 2.3277e-01 9.9249e-05 -1.9787e-03 3.4315e-04 1.5402e-04 -6.0000e+00 1.6964e-02 2.2203e-02 2.0277e-06 12 8 8 10 0 0 27.63 22.72 0.66 0.02220 0.00733 45 9 1 5 0 1103.580 25.90 20.00 22.72 13.41 28.8 968.81 900000 -142784 900000 -130015 900000 -164855 -124613 900000 -156950 900000 -168631 900000 -113824 -1212 -50641 900000 64021 -40546 900000 -66494 93051 -45858 900000 -72806 900000 -62778 4214 36010 -53448 83752 -12183 900000 -13680 80296 -5636 42408 72564 40134 232855 7596 124079 8918 308106 29688 58169 39349 47043 65198 27156 93584 20495 111622 16136 50219 26127 35379 26656 26899 61220 24098 55969 9209 28074 14216 27937 15693 12957 21259 10039 14350 6055 27298 2354 16124 -926 2879 943 -211 3648 -1465 6541 -5475 5634 -5927 6674 -840 2414 6015 33 1546 -7137 2635 -5924 153 -6176 -3587 -2623 -3015 644 -3275 802 -2360 -275 -4855 -2005 -2819 295 -1945 -2424 433 -3825 -15 -1585 1072 -1802 985 -563 752 667 -720 3777 550 2863 830 3593 908 2235 769 442 1361 -295 955 -146 812 -270 438 355 -686 -34 -129 -703 -2044 900000 -4673 900000 -3073 900000 -4646 -2595 900000 -4423 900000 -5672 900000 -3518 -17 -1406 900000 698 -1327 900000 -2539 1015 -1410 900000 -3105 900000 -2428 79 464 -1749 914 -387 900000 -570 1274 -196 925 1295 1154 2540 407 2215 522 3361 1413 2077 1717 1960 2393 1562 3063 1565 3764 1536 3636 2488 3123 2538 2428 3704 2079 3719 1105 3230 1913 3657 2140 1897 3092 1853 2844 1376 4988 518 2785 -168 500 167 -39 776 -396 1915 -2051 2033 -2543 2682 -380 1086 2625 15 647 -3050 994 -2526 69 -3520 -2374 -2032 -2667 574 -2927 629 -1695 -180 -3452 -1471 -2201 242 -1814 -2603 521 -5372 -22 -2311 1484 -2479 1310 -786 1089 1004 -1090 5219 747 3667 1044 4273 1085 2709 1071 721 2509 -614 2118 -350 2067 -738 1222 1001 -1957 -91 -326 -1656 -4582 SS 20231225T132914.9Z 8759.561978 294 1 49.87 2 80.14 132.67 107.14 329.82 0.00 1 0.00 1 0 25 6.627e-01 1.051e-02 2.346e-01 4.412e-03 8.188131e-01 2.430210e-03 8.830981e-03 -6.000000e+00 3.794706e-01 223.16 -2.00 3.50 -2.00 321.76 0.00e+00 5.157994e-03 1.055875e-03 1.083374e-03 -6.000000e+00 1.545216e-02 276.89 -2.00 20.00 -2.00 321.45 0.00e+00 5.586 0.003 302.00 328.00 3 7.6608e-01 7.7661e-03 7.0328e-02 -6.0000e+00 9.4001e-01 2.5792e-01 1.2354e-02 4.4581e-02 -6.0000e+00 1.0257e+00 -3.1490e-01 1.5326e-02 2.6575e-02 -6.0000e+00 6.0490e-01 1.1666e-01 7.3339e-03 9.4539e-03 -6.0000e+00 2.5687e-01 3.9921e-04 -6.1255e-04 1.2820e-04 1.2575e-04 -6.0000e+00 1.8721e-02 2.0853e-02 2.4350e-05 12 8 8 10 0 0 -14.13 22.72 0.39 0.02085 0.01625 111 23 1 5 0 449.190 25.90 20.01 22.72 14.27 28.9 974.92 -172882 -194873 -238142 -252665 -140878 -211317 -217017 -206128 -117108 -213258 -237342 -99099 -185665 -135886 -143604 -24118 -93774 -42561 -62773 -36410 -24907 -97992 -55143 -67903 -13384 -80129 -46022 -21285 -31713 -33506 -15386 5361 -16215 16856 -39765 2102 10957 15584 16916 6645 20843 10191 8958 8663 19465 4341 10739 8359 14164 10223 4910 13620 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