File name: Pandora64s1_NewHavenCT_20240203_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240204T051101.1Z 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 v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240203_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: 20240203 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 20240203T123309.3Z 8799.523024 246 1 23.17 2 85.37 116.89 65.73 202.10 0.00 1 0.00 1 0 25 5.730e-01 1.351e-01 3.705e-01 7.385e-02 1.213100e+00 4.475435e-02 1.414003e-02 -6.000000e+00 3.435822e-01 224.42 -2.00 3.52 -2.00 320.33 0.00e+00 4.267116e-03 8.485015e-03 1.816719e-03 -6.000000e+00 1.521023e-02 274.94 -2.00 20.00 -2.00 319.61 0.00e+00 10.396 0.021 302.00 328.00 3 -8.3152e-01 1.2163e-01 1.2139e-01 -6.0000e+00 8.5097e-01 3.7194e+00 1.4031e-01 6.2713e-02 -6.0000e+00 9.2616e-01 -2.5276e+00 7.8954e-02 2.9541e-02 -6.0000e+00 5.4814e-01 5.2268e-01 3.9118e-02 9.9036e-03 -6.0000e+00 2.3222e-01 4.2949e-06 1.7285e-03 1.7439e-03 1.5725e-04 -6.0000e+00 1.7258e-02 2.3477e-03 -2.0707e-04 12 9 9 12 1 1 86.92 21.61 0.50 0.00235 0.01534 6 4 1 5 0 3309.510 26.11 19.98 21.61 6.54 36.8 942.64 19588 54647 27956 16176 25653 143805 -42529 -22254 900000 146700 -44904 47257 -12705 50364 1095 116780 4635 161610 30056 68091 15959 900000 182509 24643 -626 104491 -32652 134065 -37619 -80096 12516 13153 9734 110074 14170 900000 35113 1869 62927 53380 63348 127357 23816 -33946 13806 18407 49061 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-13947 4365 -433 -55862 12529 25 15617 7671 19840 5153 18506 -4571 -6738 16610 -9261 -1992 12542 26143 13250 29283 16940 -9490 3493 8833 -11781 13728 -10365 -5646 -1120 33638 875 29084 19356 15500 -3062 19307 -714 699 -13183 -13901 -18806 -1448 -22095 7292 -719 -23831 12991 -621 -23665 19255 8259 7635 -2861 -6504 -10035 -4545 -1772 -11533 19909 688 7922 3002 -8177 13660 SS 20240203T124437.6Z 8799.530991 249 1 48.09 2 83.46 118.88 66.60 204.80 0.00 1 0.00 1 0 25 5.113e-01 3.120e-02 1.604e-01 8.635e-03 1.234580e+00 5.254941e-03 1.388700e-02 -6.000000e+00 3.049607e-01 224.42 -2.00 3.52 -2.00 322.44 0.00e+00 3.364902e-02 2.600676e-03 1.743979e-02 -6.000000e+00 1.319816e-02 274.94 -2.00 20.00 -2.00 322.06 0.00e+00 7.976 0.009 302.00 328.00 3 -9.4932e-02 1.9034e-02 1.6400e-01 -6.0000e+00 7.5360e-01 2.2938e+00 2.1868e-02 1.8136e-01 -6.0000e+00 8.1801e-01 -2.8554e+00 1.4443e-02 3.8221e-02 -6.0000e+00 4.8626e-01 1.1335e+00 8.0001e-03 3.5156e-02 -6.0000e+00 2.0650e-01 4.1351e-05 -3.9518e-03 2.0436e-04 2.4721e-04 -6.0000e+00 1.5186e-02 -5.8870e-04 -9.9500e-05 12 9 8 11 8 0 -15.52 21.59 0.22 -0.00059 -0.03028 80 19 1 5 0 601.020 26.11 20.00 21.59 6.63 36.9 943.49 140162 174237 139623 120839 -90890 65965 30941 -11630 -12068 -18855 -31216 1985 22003 33994 101284 93874 113300 142564 73469 149743 78104 121519 115052 60414 -22630 1838 -8698 -38785 5206 -53239 26561 65555 57484 57359 46277 48682 54744 31562 52874 41749 100322 39996 90555 8518 41650 26931 62639 27278 34421 5853 80587 168065 119808 33919 55195 33061 31965 11301 40488 16461 8419 5633 46301 39607 64551 17095 38970 39276 44925 27261 33880 23360 26899 10682 -6345 -7263 32076 -175 3159 8782 5454 -6554 9126 4387 1472 -758 5275 4986 6143 4196 -4768 -2880 -12083 -10304 -4022 -1373 -4076 256 1326 50 95 -1933 -9301 -904 -4742 -5591 -5015 -1307 -5909 -3067 -1940 -1914 -1979 -1217 -2044 -2546 -406 -93 1628 3073 1787 3745 3821 5154 4598 3550 -1785 957 1860 1039 910 98 -162 10 537 255 -412 232 815 -505 -883 -3141 4935 4401 4596 3792 -15011 2070 1066 -490 -425 -621 -1123 64 825 1561 3024 3521 3729 3601 3487 2980 2690 2456 2131 1480 -1074 60 -293 -1722 163 -3790 1139 2258 2376 2283 1771 1845 1936 1329 2092 1758 2619 1745 2669 515 1999 1402 2637 1608 2029 497 3935 3679 4439 2778 3549 2531 2324 926 2523 1159 677 530 3402 3608 4892 2120 4116 4389 5261 4194 5005 3737 3788 1554 -947 -990 3020 -26 566 1849 1407 -2014 2593 1360 491 -265 1777 1679 1996 1316 -1539 -901 -4366 -4237 -1910 -784 -2888 204 1050 40 74 -1344 -6193 -551 -3168 -3935 -3839 -1087 -5618 -3385 -2462 -2657 -2866 -1763 -2951 -3694 -600 -143 2551 4662 2567 4902 4801 6199 5465 4240 -2303 1394 3280 2024 2035 243 -441 27 1556 759 -1230 684 2303 -1422 -2267 -7527 SS 20240203T125455.2Z 8799.538139 252 1 48.44 2 81.78 120.70 67.46 207.18 0.00 1 0.00 1 0 25 5.283e-01 2.409e-02 1.204e-01 3.209e-03 1.077302e+00 1.899274e-03 1.176400e-02 -6.000000e+00 3.151292e-01 224.42 -2.00 3.52 -2.00 322.12 0.00e+00 1.981606e-02 1.053739e-03 8.368402e-03 -6.000000e+00 1.363795e-02 274.94 -2.00 20.00 -2.00 321.73 0.00e+00 6.568 0.005 302.00 328.00 3 1.7464e-01 6.9641e-03 1.0897e-01 -6.0000e+00 7.7873e-01 1.0398e+00 9.9197e-03 1.0931e-01 -6.0000e+00 8.4528e-01 -1.3955e+00 1.0177e-02 3.4235e-02 -6.0000e+00 5.0247e-01 5.7531e-01 4.6733e-03 2.2470e-02 -6.0000e+00 2.1339e-01 1.8566e-04 -2.5197e-03 8.1428e-05 2.1523e-04 -6.0000e+00 1.5692e-02 -5.7210e-04 -9.1394e-05 12 8 8 10 0 0 0.90 21.56 0.24 -0.00057 -0.01951 189 45 1 5 0 256.280 26.11 20.01 21.56 7.01 36.8 945.05 -122477 -97285 -123289 -126883 -290282 -143952 -157981 -166294 -155754 -106986 -169644 -108701 -113524 -76728 -43438 -32385 -31879 3859 5782 25023 79 7797 2850 -53368 -21441 -25670 -45616 -61863 -30954 -58091 1358 18725 26938 18059 27508 6217 27299 36646 28726 27204 57923 29506 37970 23912 48504 34790 54677 35499 37506 25942 52734 55255 67995 40465 46558 37658 31989 20359 33240 20795 24438 21786 30766 33300 37090 24101 25900 24664 22497 21379 21497 15345 13602 9991 6293 4690 10834 799 4129 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