File name: Pandora64s1_NewHavenCT_20231223_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240123T152811.6Z 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 v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20231223_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: 20231223 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 20231223T130141.7Z 8757.542843 205 1 49.11 2 83.64 129.08 118.83 347.36 0.00 1 0.00 1 0 17 8.953e-01 7.651e-02 3.345e-01 3.065e-02 9.668080e-01 1.845962e-02 1.183551e-02 -6.000000e+00 5.452371e-01 222.96 -2.00 3.52 -2.00 321.55 0.00e+00 9.797892e-03 6.484573e-03 5.559269e-03 -6.000000e+00 2.443298e-02 276.40 -2.00 20.00 -2.00 321.01 0.00e+00 8.161 0.010 302.00 328.00 3 1.7916e+00 5.7252e-02 9.6791e-02 -6.0000e+00 1.3526e+00 2.1239e+00 6.6595e-02 5.1822e-02 -6.0000e+00 1.4790e+00 -2.2421e+00 4.0851e-02 2.8713e-02 -6.0000e+00 8.6671e-01 8.1516e-01 2.1943e-02 1.1597e-02 -6.0000e+00 3.6357e-01 6.6368e-06 -1.6065e-03 8.2981e-04 2.4398e-04 -6.0000e+00 2.7340e-02 6.2046e-04 -5.1131e-05 12 9 8 11 8 0 94.39 21.68 0.94 0.00062 -0.01145 17 4 1 5 0 2888.800 26.11 20.00 21.68 3.58 36.1 924.57 146321 73849 240369 79052 900000 45918 138356 -72258 900000 338567 22594 110092 90172 -21312 201852 79845 97231 900000 30968 399050 112364 900000 900000 272455 70873 97584 29745 46191 14175 -103802 -12335 107667 69606 900000 38716 900000 69300 48445 22714 50175 123582 240424 15737 -30796 1328 43678 91563 67996 48888 -73362 88624 900000 900000 25499 49726 37371 -7473 35687 58871 39217 28413 62692 26941 63685 133386 12798 16868 75847 59679 20772 38529 55033 16360 8514 -12900 -2530 480767 8245 -15881 36681 -11092 35058 14500 -2066 7567 -5274 24912 -1369 21222 6770 -16373 589 -16361 -15681 5412 12448 2413 -2671 212 -7838 -1761 -8630 -6772 -5490 -5574 -16066 -4798 21927 -5437 3488 6164 -4496 -1129 3072 1977 -7891 2959 2920 -3326 2359 -3715 4868 2181 8453 9445 667 -999 9206 223 -2172 -2898 -3619 -1111 728 2745 -129 823 1761 3274 -634 -4678 -1674 9757 9301 7170 7213 900000 4029 4370 -16525 900000 10100 1824 4250 5221 -4274 6021 7706 8019 900000 4673 11904 6112 900000 900000 8127 4625 4548 2349 3014 1194 -30276 -1818 5621 5710 900000 3609 900000 4780 4516 2870 5519 6682 7172 2320 -6917 210 4723 6146 5958 5378 -27420 7601 900000 900000 4474 7231 6062 -1718 5256 6366 4972 4132 7130 4922 8905 9450 2807 3670 10181 10459 5540 8857 11184 4249 2136 -3509 -594 14341 1891 -5183 8959 -4749 10704 5801 -1019 3558 -2906 10360 -735 8826 3053 -8705 257 -8699 -9273 3058 7754 1935 -2425 197 -7638 -1482 -7269 -5169 -4248 -4568 -14404 -4412 17045 -6019 4070 7855 -6743 -1661 4261 2694 -11756 4090 4205 -5303 3522 -5609 6382 2849 10002 10831 821 -1268 11977 373 -4247 -6369 -8192 -2636 1819 7162 -355 2258 4793 8492 -1590 -11319 -3876 SS 20231223T132201.0Z 8757.556956 211 1 48.38 2 80.76 132.78 119.40 352.56 0.00 1 0.00 1 0 25 2.684e-01 3.457e-02 8.729e-02 9.219e-03 7.730230e-01 5.124383e-03 9.729142e-03 -6.000000e+00 1.589213e-01 222.97 -2.00 3.52 -2.00 321.14 0.00e+00 8.527007e-03 1.936563e-03 5.378989e-03 -6.000000e+00 6.975896e-03 276.40 -2.00 20.00 -2.00 320.62 0.00e+00 5.921 0.004 302.00 328.00 3 2.9555e+00 1.5703e-02 7.4158e-02 -6.0000e+00 3.9121e-01 9.7360e-01 1.8786e-02 4.7295e-02 -6.0000e+00 4.2525e-01 -1.1932e+00 1.3591e-02 2.4591e-02 -6.0000e+00 2.5328e-01 4.9456e-01 6.8692e-03 7.7496e-03 -6.0000e+00 1.0782e-01 2.8550e-05 -4.7770e-03 2.5901e-04 1.7303e-04 -6.0000e+00 7.9753e-03 4.3162e-03 -4.5433e-04 12 9 8 11 32 0 99.75 21.67 -0.16 0.00432 -0.03158 17 4 1 5 0 2845.390 26.11 19.99 21.67 3.38 35.9 922.93 -41354 -24249 12652 -69399 20268 -71544 -73620 -121830 -43116 -74337 -73234 -62856 -41968 -41075 13494 -4097 15587 35807 23762 8335 54437 66022 46408 8433 18650 -15597 -19934 -1016 -11571 -74237 -974 32013 23169 25904 21560 12431 9105 22524 19050 27610 28545 54297 30995 -306 13701 30601 19271 27780 28198 -3714 41958 51040 53787 24206 23862 14787 13490 23248 14668 12570 7995 14616 20875 19951 19283 4813 11419 19419 10173 8789 12207 9725 3625 -516 -444 -5432 8846 -6743 -7725 583 -2892 -15514 -1702 -3483 -1206 -3681 702 -1972 1563 437 -4854 511 -10289 -7321 -4116 -2681 -4815 -2198 -95 -2210 -2785 -3735 -5954 -2187 -2652 -5572 -2208 4068 -1397 1463 3593 402 1124 649 -182 -1661 426 176 1588 1856 386 3123 3305 3157 3567 1492 -1176 1553 1976 570 156 -1639 -335 -152 1424 179 230 64 372 -980 -1359 -2831 -2602 -1333 498 -4748 547 -4237 -4360 -11133 -1915 -4481 -4414 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-2.00 320.51 0.00e+00 5.168 0.002 302.00 328.00 3 1.2666e+00 3.2653e-03 6.3522e-02 -6.0000e+00 7.0668e-01 1.3319e-01 4.3699e-03 3.8054e-02 -6.0000e+00 7.6760e-01 -1.7760e-01 4.4879e-03 2.2723e-02 -6.0000e+00 4.5720e-01 6.8998e-02 2.1805e-03 1.0094e-02 -6.0000e+00 1.9502e-01 4.0792e-04 -9.9253e-04 5.3572e-05 1.3555e-04 -6.0000e+00 1.4366e-02 -2.2401e-04 -6.2417e-05 12 8 8 10 0 0 98.23 21.63 0.20 -0.00022 -0.00768 178 43 1 5 0 271.020 26.11 20.00 21.63 3.84 36.2 925.76 -132561 -160060 -145943 -160011 -273078 -154068 -127149 -163897 -105901 -124843 -119068 -119886 -77781 -85349 -41122 -58437 -24458 -41154 -26189 -32601 -19142 -15412 125 -31926 -11326 -29260 -15588 -31343 -12093 -36766 3169 -9350 4113 -5431 3151 -5827 5760 -1276 8285 2922 8847 1834 8311 2487 11013 8040 10857 7725 6618 1041 9178 6151 9051 5695 5238 4706 1128 1526 1126 2414 2177 3881 4672 6221 3865 1959 1496 2019 1723 3335 1382 1992 141 1384 -1065 -1466 -1305 -2383 -2438 -322 -2339 -1044 -2522 -2320 -969 -194 158 600 983 748 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