File name: Pandora64s1_NewHavenCT_20231103_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20231104T044130.6Z 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 v1.8.49 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20231103_L1_smca1c4d20190911p1-8.txt 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: 20231103 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 20231103T120757.7Z 8707.505529 278 1 48.67 2 83.45 116.69 35.29 258.30 0.00 1 0.00 1 0 25 3.422e-01 3.140e-02 1.869e-01 1.074e-02 9.669471e-01 6.274746e-03 1.092307e-02 -6.000000e+00 2.038619e-01 224.22 -2.00 3.52 -2.00 322.05 0.00e+00 4.874344e-03 3.166698e-03 1.048337e-03 -6.000000e+00 9.082548e-03 281.70 -2.00 20.00 -2.00 321.56 0.00e+00 7.955 0.009 302.00 328.00 3 8.1783e-01 2.2678e-02 9.4464e-02 -6.0000e+00 5.0237e-01 1.4748e+00 2.7831e-02 5.1873e-02 -6.0000e+00 5.4486e-01 -1.8472e+00 2.0225e-02 2.6757e-02 -6.0000e+00 3.2526e-01 7.1530e-01 1.0066e-02 9.0121e-03 -6.0000e+00 1.3894e-01 2.8730e-05 -3.1625e-03 2.9242e-04 1.4283e-04 -6.0000e+00 1.0165e-02 3.0062e-03 -1.5990e-04 12 8 8 10 0 0 22.46 21.20 0.36 0.00301 -0.02076 45 11 1 5 0 1081.430 25.79 20.01 21.20 8.66 36.7 942.38 -27453 18254 -19559 57397 -48516 52391 -70763 -32770 -24577 14533 -99015 119732 -65374 27796 9577 57382 -4681 67554 22068 80682 14802 67537 52198 45918 13169 12123 -43640 -22046 -24047 -98061 15267 4637 36900 22397 53855 5837 46361 -18879 32349 5870 70372 14979 66151 -11138 35043 -6923 105202 -4143 41234 -31152 80627 26152 62485 11442 77005 26616 74947 8469 65429 -1323 36908 98 40202 18328 62679 2157 37319 30977 24381 13779 22452 20437 17289 4758 3705 -14223 26203 -5700 -3061 9137 821 -11935 -709 1138 4075 1759 1208 4387 1049 4974 -7416 345 -10685 -119 -2854 1841 -6238 1201 -3203 -391 -4192 -2215 -9643 -371 -7576 -4232 -5832 4693 -3467 1219 152 -120 -1311 2252 -1646 -817 -906 1596 -916 1860 119 3060 2389 3394 3267 1787 -2102 2452 1670 487 103 -823 -354 -666 917 -108 380 36 1685 -427 -522 -3057 -1568 660 -968 1092 -2216 798 -3569 -1123 -772 304 -6502 1253 -4417 899 437 1802 -285 2263 1029 2196 648 1767 1585 1490 579 520 -2783 -1049 -1284 -11292 751 260 1816 1243 1973 342 1941 -1563 2032 486 3536 1212 3532 -1134 2421 -659 3634 -406 2978 -4565 4726 2613 5102 1503 5885 3090 5806 1096 4931 -171 3709 14 4476 2843 7086 404 5150 4835 4571 3200 5000 4629 3784 1069 744 -3100 3815 -1248 -778 2470 281 -5315 -305 507 1869 859 610 2150 520 2244 -3564 151 -5359 -60 -1611 1178 -5055 1036 -3065 -356 -3664 -1687 -7327 -264 -6180 -3496 -5321 4266 -3929 1525 217 -169 -1903 3117 -2309 -1221 -1295 2324 -1428 2813 175 4492 3430 4669 4409 2410 -2983 3760 2804 947 225 -1966 -907 -1709 2478 -304 1073 102 4579 -1104 -1352 -7594 SS 20231103T121822.9Z 8707.512765 281 1 48.31 2 81.72 118.53 37.17 260.43 0.00 1 0.00 1 0 25 4.473e-01 2.429e-02 1.345e-01 3.625e-03 8.321404e-01 2.080871e-03 1.011623e-02 -6.000000e+00 2.666011e-01 224.22 -2.00 3.52 -2.00 321.70 0.00e+00 2.294875e-02 1.132466e-03 2.206176e-03 -6.000000e+00 1.187339e-02 281.69 -2.00 20.00 -2.00 321.23 0.00e+00 6.518 0.005 302.00 328.00 3 7.8659e-01 7.5194e-03 7.9241e-02 -6.0000e+00 6.5698e-01 6.6167e-01 1.0061e-02 5.0092e-02 -6.0000e+00 7.1247e-01 -9.1392e-01 9.4813e-03 2.8577e-02 -6.0000e+00 4.2532e-01 3.8100e-01 4.4352e-03 2.3000e-02 -6.0000e+00 1.8175e-01 1.4543e-04 -2.7314e-03 1.0012e-04 3.3642e-04 -6.0000e+00 1.3288e-02 1.4294e-03 -1.2762e-04 12 9 8 11 8 0 41.23 21.19 0.28 0.00143 -0.01910 120 29 1 5 0 402.510 25.79 20.00 21.19 9.90 36.7 947.82 -109313 -116204 -41650 -105333 -275921 -65915 -118774 -165244 -111950 -83603 -138236 -61599 -57341 -40187 8221 11579 -7225 89230 2866 40105 -4211 117070 33949 68163 -34480 -13109 -31479 -568 -28949 -23874 110 55084 32385 54367 10157 26569 14674 21381 23214 23076 31446 46345 20757 27683 22738 40568 36492 47106 26466 18230 36669 24640 31212 28602 25411 19198 14435 13665 17204 13826 17238 12783 20533 21275 21228 14700 16477 14051 11967 10729 10677 6964 6769 2440 1754 -1542 4229 -4260 271 1781 -99 -3044 -260 -3738 -1299 -2562 -286 -1459 2165 -139 -905 -2521 -4618 -4587 -3118 -2863 -2219 -478 412 96 -592 -2803 -4601 -2109 -2315 -4060 -2507 -1773 -1401 -399 292 -432 -224 151 -850 -655 143 -12 1190 1705 914 1740 2148 2220 2431 2162 -655 863 1344 1324 1190 240 11 -232 105 -234 -986 74 309 -417 -605 -1796 -1616 -2054 -361 -1557 -18042 -582 -1527 -3292 -1424 -798 -2176 -631 -790 -639 105 172 -146 757 60 581 -91 703 456 626 -853 -259 -745 -10 -747 -717 3 1149 973 1326 359 808 545 839 1026 1038 1394 2064 1154 1485 1337 2099 2075 2588 1913 1564 2934 2438 3109 3106 2882 2326 1814 1673 1984 1684 2193 1943 3332 3876 4024 2966 3394 2864 2802 2850 2987 2035 1880 651 424 -354 1003 -1103 80 626 -41 -1488 -133 -2092 -756 -1461 -166 -865 1222 -83 -510 -1400 -2651 -2686 -2114 -2296 -2065 -501 454 104 -596 -2575 -4011 -1851 -2170 -4055 -2673 -1913 -1708 -548 443 -693 -360 235 -1297 -986 221 -19 2001 2866 1493 2687 3209 3192 3401 2972 -930 1347 2256 2512 2498 511 25 -566 272 -627 -2525 189 816 -1042 -1420 -4019 SS 20231103T123443.0Z 8707.524109 286 1 48.39 2 79.06 121.49 40.15 263.53 0.00 1 0.00 1 0 25 4.820e-01 9.856e-03 4.375e-02 1.292e-03 6.877035e-01 7.185137e-04 7.916065e-03 -6.000000e+00 2.873530e-01 224.22 -2.00 3.52 -2.00 320.90 0.00e+00 2.973910e-03 3.242163e-04 9.340640e-04 -6.000000e+00 1.279308e-02 281.69 -2.00 20.00 -2.00 320.36 0.00e+00 5.080 0.002 302.00 328.00 3 7.2473e-01 2.3070e-03 6.2127e-02 -6.0000e+00 7.0813e-01 2.7945e-02 3.0976e-03 3.6758e-02 -6.0000e+00 7.6784e-01 -7.0514e-02 3.1016e-03 1.9937e-02 -6.0000e+00 4.5837e-01 2.4159e-02 1.5008e-03 7.1218e-03 -6.0000e+00 1.9594e-01 8.0750e-04 -1.0761e-03 3.7492e-05 9.0143e-05 -6.0000e+00 1.4320e-02 5.4250e-04 -6.9994e-05 12 8 8 10 0 0 -15.78 21.20 0.20 0.00054 -0.00754 319 77 1 5 0 151.680 25.79 19.98 21.20 11.91 36.9 956.95 -174980 -146132 -159959 -138779 -240282 -149639 -162527 -148034 -144476 -116127 -123024 -101709 -87192 -58196 -54967 -48624 -45144 -29608 -30622 -28348 -31264 -28364 -21509 -25993 -23148 -25245 -18566 -25253 -18869 -32470 -10795 -11151 -2635 -4527 -11402 -10382 642 -3713 1750 3972 5062 3162 5826 -584 3063 2947 5419 3661 4399 553 6189 4633 5228 4741 3863 3595 3432 2541 2550 1303 3352 2454 3739 4008 3104 -236 1339 -256 1459 2413 972 1326 258 410 -804 -2012 -1484 -2362 -1149 -267 -1436 -1287 -2162 -1793 -910 -595 238 339 1117 941 152 169 -1425 -439 237 -4 -277 1082 716 -408 -501 -1684 -2337 -105 100 -1618 -718 -761 -352 569 1010 443 245 90 -226 -316 344 -315 632 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