File name: Pandora64s1_NewHavenCT_20210516_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20260321T231156.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20210516_L1_smca1c4d20190911p1-8.txt.bz2 Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20210516 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 20210516T101655.5Z 7806.428421 64 1 47.09 2 83.05 70.50 109.39 26.03 0.00 1 0.00 1 0 25 5.768e-01 4.333e-02 3.963e-01 2.181e-02 1.034810e+00 1.375691e-02 1.227196e-02 -6.000000e+00 3.571462e-01 231.16 -2.00 3.52 -2.00 322.24 0.00e+00 1.935484e-02 7.387094e-03 3.154773e-03 -6.000000e+00 1.653385e-02 283.49 -2.00 20.00 -2.00 321.76 0.00e+00 7.565 0.008 302.00 328.00 3 1.9498e+00 5.2125e-02 9.5407e-02 -6.0000e+00 8.9647e-01 1.8223e+00 6.3540e-02 5.9625e-02 -6.0000e+00 9.6969e-01 -2.0915e+00 4.5750e-02 3.0637e-02 -6.0000e+00 5.7425e-01 7.7220e-01 2.2569e-02 1.8021e-02 -6.0000e+00 2.4249e-01 9.9224e-06 -2.9783e-03 6.0302e-04 3.5142e-04 -6.0000e+00 1.7298e-02 3.0885e-03 -9.3183e-05 12 8 8 10 0 0 -4.86 21.22 0.63 0.00309 -0.01929 17 4 1 5 0 2769.610 25.90 20.00 21.22 20.65 32.3 1023.65 21577 900000 237813 35324 -57265 -85276 44758 -37223 900000 147434 -80520 -38642 61966 -34945 -2224 127576 120190 900000 72518 62853 900000 900000 900000 900000 185926 57114 -27002 25412 900000 15679 11644 100479 142926 -17992 90323 52087 -7198 -28303 111271 -31676 900000 36117 80355 89581 -16721 35314 262255 31712 68053 -60892 108852 -2645 54248 15408 9790 27142 42355 -1690 900000 69181 28360 126039 80746 77293 110292 29748 25903 60693 24050 -1622 60663 12058 7415 9031 -16921 3810 8553 -2168 -31384 10456 -15982 3936 -6845 10209 -3360 14251 15246 3848 10351 3123 -11871 18302 -17978 -5158 -5345 5276 -890 2413 3476 859 -5846 -2187 -13136 611 -5178 -9345 -3864 17408 -2972 3269 2871 -7084 -755 275 -207 -3361 1709 -2693 3446 1655 1486 4809 4348 -4440 8962 686 -4786 2184 1356 -719 449 -2477 38 -361 2113 -1765 1508 -81 2249 -106 462 -3900 916 900000 5046 1102 -3443 -5831 950 -1347 900000 3128 -3920 -1495 1315 -2225 -125 2707 2550 900000 2353 2118 900000 900000 900000 900000 3945 1288 -1247 708 900000 603 552 2399 3033 -1415 2276 1865 -458 -2438 2804 -3400 900000 2203 3197 3208 -1628 2201 5565 2229 3520 -11629 4475 -337 4389 1808 1210 2952 3820 -209 900000 4129 2670 5015 5783 6458 6875 4142 3686 6842 4113 -397 8769 2634 1573 1691 -3612 637 1372 -403 -9441 2506 -5825 1341 -2794 3683 -1464 5390 5861 1657 4083 1251 -5186 5780 -8415 -2395 -2969 2986 -632 1912 2901 719 -4824 -1534 -9430 390 -3718 -7315 -3116 12600 -3044 3657 3651 -10072 -1031 368 -272 -4537 2405 -3925 4926 2394 2161 6390 5617 -6051 10459 858 -6415 3107 2185 -1362 947 -5849 94 -922 5635 -5038 4194 -230 6055 -271 1149 -9433 SS 20210516T102658.7Z 7806.435401 67 1 9.31 2 81.26 72.07 108.57 28.16 0.00 1 0.00 1 0 17 5.341e-01 3.801e-02 4.540e-01 2.655e-02 9.357715e-01 1.586216e-02 1.047544e-02 -6.000000e+00 3.291065e-01 231.16 -2.00 3.52 -2.00 321.87 0.00e+00 -1.017229e-03 8.033682e-03 1.068812e-03 -6.000000e+00 1.469525e-02 283.49 -2.00 20.00 -2.00 321.37 0.00e+00 6.212 0.004 302.00 328.00 3 2.6038e+00 5.7081e-02 8.0664e-02 -6.0000e+00 8.2550e-01 1.0997e+00 7.1859e-02 5.1505e-02 -6.0000e+00 8.9185e-01 -1.5166e+00 5.3901e-02 2.6029e-02 -6.0000e+00 5.2638e-01 6.1766e-01 2.5758e-02 7.5565e-03 -6.0000e+00 2.2098e-01 2.6570e-05 -4.5473e-03 7.2258e-04 1.1323e-04 -6.0000e+00 1.5992e-02 3.5340e-05 -4.2511e-04 12 9 9 12 1 1 77.01 21.22 0.10 0.00004 -0.03413 3 5 1 5 0 2284.350 25.90 20.00 21.22 21.64 32.2 1028.95 -114066 -14508 109147 -23136 -50003 900000 42124 -105158 900000 7678 -126410 -112194 75618 -53857 -71631 14616 113348 4063 87847 63215 258795 58997 900000 47359 112167 -5875 36322 -56514 -30674 -62579 95813 3806 102862 -21273 39640 94384 3556 87713 58487 10530 22599 56477 241406 43755 68709 120324 93764 48569 72759 -38145 44236 25230 41330 7527 39390 59134 50048 38726 27419 34866 -2237 56558 9910 48298 48175 43263 9205 5303 11826 35722 12205 28999 14839 -1615 -658 32464 3082 16175 -11390 392 -13209 4350 -7703 9887 -10321 12677 -58 3600 -72 4675 -8524 1101 -10477 -8947 -6686 -1880 -3130 145 -2352 -885 -3421 -989 -9018 -1742 -3794 -4831 -1119 2239 2085 -1868 2328 -2615 -984 -2402 476 -1023 1709 -3013 1967 2042 4176 1186 7703 -859 4588 -81 -844 2434 1621 -2447 471 -1386 778 231 1339 416 566 -373 2423 -1481 -1475 -3341 -7456 -397 2824 -599 -1370 900000 1090 -4837 900000 199 -7814 -6935 1957 -2710 -5045 512 2933 173 2273 1636 6696 1527 900000 1302 2902 -259 1057 -3412 -1494 -4408 2479 197 2661 -1468 1448 2442 206 2695 2671 833 1689 3266 6246 2797 3346 3697 3791 3031 3765 -6141 3703 2648 3981 1093 4303 5760 5036 4175 3114 3558 -341 5595 1667 6179 6371 5970 1866 1189 2657 7497 3241 6920 3658 -429 -154 5227 660 3278 -3397 124 -5595 1771 -3840 4376 -5661 6077 -31 1863 -38 2343 -4585 525 -5721 -5070 -4342 -1372 -2688 137 -2321 -843 -3262 -823 -7548 -1395 -3309 -4450 -1074 2283 2307 -2470 3313 -3965 -1492 -3641 713 -1535 2573 -4735 3075 3197 6437 1789 10545 -1236 6094 -111 -1162 3617 2702 -4829 962 -3110 1834 589 3450 1117 1528 -1023 6279 -3726 -3600 -7765 SS 20210516T104947.3Z 7806.451241 81 1 48.51 2 77.14 75.61 106.49 32.87 0.00 1 0.00 1 0 25 4.607e-01 1.479e-02 9.088e-02 4.057e-03 7.007403e-01 2.298043e-03 8.304294e-03 -6.000000e+00 2.819256e-01 231.16 -2.00 3.52 -2.00 320.93 0.00e+00 2.486257e-03 1.016248e-03 3.835743e-03 -6.000000e+00 1.232242e-02 283.49 -2.00 20.00 -2.00 320.36 0.00e+00 4.373 0.001 302.00 328.00 3 3.4091e+00 7.4386e-03 6.0361e-02 -6.0000e+00 7.0579e-01 1.8106e-01 9.6386e-03 4.3616e-02 -6.0000e+00 7.6119e-01 -2.9579e-01 8.8545e-03 2.1280e-02 -6.0000e+00 4.5235e-01 1.2193e-01 4.2873e-03 5.7378e-03 -6.0000e+00 1.9100e-01 9.8944e-05 -8.5993e-04 1.1760e-04 1.0418e-04 -6.0000e+00 1.3714e-02 -4.3190e-04 -4.5889e-06 12 8 8 10 0 0 67.39 21.25 0.21 -0.00043 -0.00689 34 8 1 5 0 1426.310 25.90 20.00 21.25 23.41 32.2 1037.34 -176793 -151404 -138470 -169215 -180401 -160912 -157563 -136188 -83155 -109917 -131487 -118878 -73725 -98573 -53581 -62357 -20193 5727 -19808 -23196 31196 -14884 17502 -31626 1679 -13573 -21216 -32610 -18745 -37707 -5257 -11477 6149 -8903 7144 -8268 7926 -3615 20861 1409 22847 7189 11836 7269 10744 8278 11575 7159 5251 -8022 14095 7577 9585 4295 5506 2990 4481 2434 8661 4358 5552 5719 5238 7244 8580 3057 766 1126 2204 3680 3259 2474 259 251 -1935 43 -2101 -3295 -3623 1632 -2768 -472 -3378 -1638 -1462 -1265 198 1423 862 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