File name: Pandora69s1_NewBrunswickNJ_20240201_L2Fit_fout2c23d20210421p1-8.txt File generation date: 20240202T051426.2Z 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_20240201_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: 20240201 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 20240201T125421.2Z 8797.537746 280 1 49.63 2 82.83 119.86 67.62 230.77 0.00 1 0.00 1 0 25 5.919e-01 3.136e-02 4.603e-01 2.311e-02 1.060884e+00 1.422312e-02 1.132513e-02 -6.000000e+00 3.476535e-01 224.41 -2.00 3.50 -2.00 322.41 0.00e+00 3.301655e-03 6.054626e-03 1.503553e-03 -6.000000e+00 1.597177e-02 275.55 -2.00 20.00 -2.00 322.07 0.00e+00 7.385 0.007 302.00 328.00 3 9.7735e-01 4.6915e-02 9.2177e-02 -6.0000e+00 8.6360e-01 1.6405e+00 5.7323e-02 5.4475e-02 -6.0000e+00 9.4390e-01 -2.0392e+00 5.1696e-02 3.0043e-02 -6.0000e+00 5.5316e-01 7.9246e-01 2.7846e-02 1.0618e-02 -6.0000e+00 2.3548e-01 3.6176e-05 -1.6117e-03 6.6606e-04 1.7413e-04 -6.0000e+00 1.7563e-02 2.1549e-02 -2.1515e-05 12 8 8 10 0 0 97.66 22.84 0.77 0.02155 0.00944 21 4 1 5 0 2362.990 26.00 20.00 22.84 7.13 28.6 947.02 71079 161891 -68748 900000 -68326 900000 -39380 57439 900000 -16680 900000 12863 -1792 39468 900000 -27952 187710 38441 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2247 4704 2989 4321 4213 1299 3648 3949 4805 4936 5003 1401 2782 1056 4180 4106 5593 2673 -25 2895 -1042 -2320 -948 2071 2 2337 1142 4212 -227 444 5468 1693 4304 1503 3473 -2964 1028 333 545 -1741 -6342 -4886 -2875 499 -557 -1646 -3451 -1445 -847 -1150 677 -7064 1167 -4985 -1359 -4521 2822 1951 -2200 -2592 762 4682 -4437 1510 -5879 -1360 3464 288 5090 401 7028 533 5607 -194 2096 -3539 2424 2536 591 859 452 -351 -1439 5313 -1348 -1172 -1373 -199 -5032 SS 20240201T130528.8Z 8797.545472 283 1 50.34 2 81.01 121.82 69.28 233.02 0.00 1 0.00 1 0 17 6.436e-01 2.137e-02 4.374e-01 1.312e-02 9.410731e-01 7.686990e-03 1.001939e-02 -6.000000e+00 3.738929e-01 224.41 -2.00 3.50 -2.00 322.11 0.00e+00 2.122369e-03 3.419010e-03 1.398280e-03 -6.000000e+00 1.602242e-02 275.55 -2.00 20.00 -2.00 321.77 0.00e+00 6.068 0.004 302.00 328.00 3 1.7196e+00 2.5363e-02 7.8565e-02 -6.0000e+00 9.2922e-01 6.7966e-01 3.8257e-02 5.1280e-02 -6.0000e+00 1.0145e+00 -8.7650e-01 4.4583e-02 3.0400e-02 -6.0000e+00 5.9400e-01 3.5104e-01 2.1426e-02 1.0935e-02 -6.0000e+00 2.5492e-01 8.0097e-05 -1.4475e-03 3.8532e-04 1.5485e-04 -6.0000e+00 1.8573e-02 2.0430e-02 -1.5899e-06 12 8 8 10 0 0 81.87 22.85 0.38 0.02043 0.00955 38 8 1 5 0 1324.530 26.00 20.00 22.85 8.06 28.5 952.77 900000 -183813 900000 -112391 900000 -82576 -225541 900000 -196897 -181936 -195636 -209231 -93708 -66403 -120846 70246 63398 -147150 96879 -99809 900000 -57976 900000 -21517 46258 -77909 -51445 7534 -47011 97852 -61538 68444 68958 244585 -2486 72425 136034 -30017 161201 38531 125501 -2567 99540 5370 62561 16259 19789 22906 30390 55656 -16598 38596 41847 41676 18703 18129 17034 18194 28367 14001 18419 -16778 23279 593 15982 20061 19934 25090 16319 20362 2339 17877 10342 13371 -1251 230 -6437 -1063 -1030 -1929 3400 -4466 -860 -4165 4469 1815 -665 3493 2827 2768 -4834 806 6 -3843 -4772 -209 -1486 -2813 1363 -1325 -361 -2463 1141 431 -3158 -3575 1233 -105 -993 -1297 -1486 -1304 -1722 -306 -685 -568 223 934 971 -417 803 159 3075 2268 2891 1127 1103 575 -1718 2678 -618 266 -184 462 -90 -197 1771 -52 44 -980 -383 -2082 900000 -2635 900000 -1436 900000 -1055 -4251 900000 -3325 -2792 -3735 -5631 -1197 -848 -2909 897 810 -6238 1237 -2832 900000 -1085 900000 -327 591 -2131 -1072 96 -947 1250 -2090 874 914 3124 -61 925 1738 -1304 2059 1221 1917 -134 2076 266 1849 751 921 1102 1476 2386 -1561 2413 2779 2988 1732 1740 1652 1679 2275 1269 1701 -2423 2673 93 2244 2748 2873 3736 2994 4028 580 3824 2243 2568 -246 41 -1236 -216 -250 -566 1110 -1776 -356 -1884 1980 860 -332 1682 1338 1236 -2184 338 3 -1969 -2901 -144 -1218 -2639 1280 -1232 -305 -1891 793 311 -2504 -2997 1067 -102 -1107 -1665 -2122 -1958 -2612 -448 -973 -801 322 1401 1506 -648 1180 224 4071 2913 3594 1394 1403 829 -2932 4968 -1305 601 -443 1183 -245 -551 4914 -147 120 -2506 -906 -4728 SS 20240201T131833.8Z 8797.554558 288 1 49.70 2 78.92 124.18 71.29 235.58 0.00 1 0.00 1 0 25 5.799e-01 1.077e-02 2.263e-01 4.752e-03 8.070234e-01 2.623563e-03 8.740167e-03 -6.000000e+00 3.358904e-01 224.41 -2.00 3.50 -2.00 321.63 0.00e+00 4.788056e-03 1.095163e-03 1.003380e-03 -6.000000e+00 1.362096e-02 275.55 -2.00 20.00 -2.00 321.32 0.00e+00 5.023 0.002 302.00 328.00 3 1.3962e+00 8.1901e-03 6.5670e-02 -6.0000e+00 8.3413e-01 2.9101e-01 1.2430e-02 4.3725e-02 -6.0000e+00 9.0987e-01 -3.3680e-01 1.5140e-02 2.5686e-02 -6.0000e+00 5.3412e-01 1.2867e-01 7.3553e-03 9.0050e-03 -6.0000e+00 2.2537e-01 3.5301e-04 -7.9535e-04 1.3696e-04 1.1586e-04 -6.0000e+00 1.6490e-02 2.0850e-02 -2.5879e-05 12 8 8 10 0 0 99.36 22.86 0.36 0.02085 0.01487 90 18 1 5 0 552.060 26.00 19.98 22.86 8.86 28.6 958.62 -237001 124824 -239149 119321 -208158 900000 -216941 -140151 -211406 -160255 -140236 -177181 -127684 -127134 62558 -76171 785 -47839 -47025 -13481 -49682 3437 -37371 2808 -67991 -12843 -77146 -12765 -26192 -69768 -7500 -31 41270 -31066 54737 -13706 -2305 -13964 10453 6683 11134 17381 4371 23187 7288 10079 9232 57 8952 10053 9164 6347 14978 4931 10699 4728 7403 -2972 6679 3787 4123 8367 3473 9437 2617 6726 249 1580 2674 5474 2698 3187 4158 2033 2198 -4878 -451 -1831 -2544 -2890 -1042 -1110 -1356 -1040 -1905 295 548 816 526 1430 133 -695 -699 -1107 -99 -810 548 -28 -399 -229 -343 -818 -426 -598 -3078 -523 -1545 135 -214 -581 -576 -140 30 -145 571 16 855 129 -144 -417 915 407 234 947 295 705 1032 799 -72 323 244 156 428 -61 -104 -496 331 -324 -242 -197 -132 -138 -3019 578 -3600 553 -2191 900000 -2832 -944 -3205 -1552 -1240 -2910 -1721 -2249 290 -1219 7 -725 -752 -159 -837 35 -614 33 -1575 -195 -2025 -188 -474 -2181 -171 -1 782 -1115 876 -423 -73 -598 428 330 576 899 268 1199 453 630 609 4 684 850 888 649 1677 610 1308 633 971 -419 828 487 570 1264 637 1802 545 1347 55 375 716 1607 865 1020 1250 570 550 -1205 -106 -485 -810 -1103 -455 -547 -718 -583 -1150 183 349 522 329 832 73 -373 -384 -677 -70 -678 528 -31 -450 -247 -338 -724 -355 -521 -2915 -508 -1633 154 -276 -854 -863 -216 46 -231 860 24 1311 210 -243 -703 1461 624 346 1333 405 936 1393 1209 -126 632 486 333 965 -147 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