File name: Pandora64s1_NewHavenCT_20240925_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240926T045318.4Z 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 v1.8.60 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240925_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: 20240925 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 20240925T112522.0Z 9034.475950 252 1 48.30 2 82.86 97.88 13.29 181.69 0.00 1 0.00 1 0 25 8.128e-01 6.828e-02 2.535e-01 2.021e-02 7.513953e-01 1.167304e-02 1.376405e-02 -6.000000e+00 4.914643e-01 228.03 -2.00 3.52 -2.00 321.27 0.00e+00 7.155369e-02 4.236607e-03 5.357247e-03 -6.000000e+00 2.200025e-02 286.35 -2.00 20.00 -2.00 320.72 0.00e+00 7.396 0.007 302.00 328.00 3 2.0456e+00 3.7353e-02 8.8586e-02 -6.0000e+00 1.2198e+00 1.8198e+00 4.2008e-02 9.6153e-02 -6.0000e+00 1.3182e+00 -2.0300e+00 2.1739e-02 2.1809e-02 -6.0000e+00 7.8679e-01 8.0527e-01 1.2386e-02 4.9399e-02 -6.0000e+00 3.3523e-01 1.2218e-05 -6.1477e-03 5.4597e-04 9.8366e-04 -6.0000e+00 2.4186e-02 4.8055e-03 1.6766e-05 12 9 8 11 8 0 99.48 21.34 -0.07 0.00481 -0.04139 21 5 1 5 0 2299.730 25.79 20.00 21.34 20.69 39.8 996.36 151305 246919 229068 228850 -48875 212488 56227 47566 87047 288647 -66251 96815 23332 84975 140171 168534 145225 209530 143539 207410 129738 235984 900000 194576 53019 102775 7197 16695 92218 -78728 82746 73460 128582 122880 157364 60103 98967 52796 43502 16580 82593 30324 72045 -18458 53124 57344 125271 43898 122267 -9655 126049 69185 169755 31847 60896 7559 13569 6699 42702 -1848 23627 4260 67755 -6220 64382 10512 21662 45054 43659 10593 31240 3458 8459 -14390 -1576 -16587 34952 -9629 -14014 6230 11642 -9665 -2837 791 -5907 -7751 329 -5946 1792 16070 -21342 5518 -23237 -13784 -13909 4792 -8092 2209 3871 -766 1261 2193 -14839 -1249 -12393 -6011 -8891 13000 -6620 3253 1787 -1547 -2938 1878 276 -3798 -1383 1695 -87 5256 2889 6442 4065 8114 6900 2442 -1761 4429 2417 197 706 -768 -898 -797 921 -149 -769 -976 2041 -940 -724 -3800 15074 11163 12480 10611 -22152 6543 4863 3253 3109 5688 -6673 2798 1920 5811 7637 9133 10437 9032 11148 8430 9324 5270 900000 3834 2808 2970 451 1069 3513 -17065 5809 6472 7760 7718 6409 5156 5851 4529 4034 1999 5391 3199 5768 -3516 5665 6381 8023 6361 8885 -2410 9625 9142 9366 5753 8047 1456 2258 1107 5098 -344 4026 965 9974 -1942 11568 2969 5431 8928 9320 3444 8482 1219 2648 -5120 -440 -4866 6361 -2793 -5094 2251 4601 -5012 -1459 405 -3388 -4711 191 -3737 1037 7733 -13878 2587 -14195 -8220 -9709 3335 -7223 2069 3859 -790 1186 1913 -13276 -1034 -11600 -5526 -9093 12337 -8179 4138 2558 -2403 -4626 2739 393 -5568 -2059 2586 -142 8369 4586 9426 5887 10864 9035 3277 -2436 6301 4053 381 1431 -1689 -2091 -1964 2368 -399 -2093 -2694 5385 -2417 -1743 -8860 SS 20240925T114601.0Z 9034.490289 260 1 8.51 2 79.04 101.39 14.04 200.33 0.00 1 0.00 1 0 25 2.890e-01 9.301e-03 1.099e-01 3.527e-03 6.006802e-01 1.945022e-03 6.958374e-03 -6.000000e+00 1.747350e-01 228.03 -2.00 3.52 -2.00 320.55 0.00e+00 2.703719e-03 8.012517e-04 1.343532e-03 -6.000000e+00 7.822260e-03 286.35 -2.00 20.00 -2.00 319.91 0.00e+00 5.067 0.002 302.00 328.00 3 1.1064e+00 6.1328e-03 5.9758e-02 -6.0000e+00 4.3369e-01 2.4240e-02 7.8608e-03 3.2402e-02 -6.0000e+00 4.6870e-01 -5.1099e-02 7.1934e-03 1.7067e-02 -6.0000e+00 2.7975e-01 1.3568e-02 3.5595e-03 5.6783e-03 -6.0000e+00 1.1912e-01 6.1232e-04 -6.1920e-04 1.0546e-04 7.5486e-05 -6.0000e+00 8.5955e-03 3.2127e-03 -7.7768e-05 12 9 1 12 1 1 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13 -157 -98 -407 -621 -274 -141 535 75 191 266 493 -69 40 430 258 163 368 -345 920 776 754 446 886 358 658 -65 130 -56 850 1465 1167 969 907 -5 168 -501 641 833 422 977 23 380 -511 -893 -628 -1412 -1368 40 -917 -992 -1870 -1396 -720 -245 96 744 1043 551 439 606 -615 -244 542 359 -492 1385 633 -274 -604 -2006 -2301 279 236 -1937 -342 -1261 -412 876 1104 751 -347 524 -542 -377 662 -107 1612 991 -604 -523 905 751 1459 381 -2269 468 2064 577 703 -814 -1852 -933 1148 -778 -714 936 533 -392 551 -1234 SS 20240925T115134.2Z 9034.494145 263 1 48.30 2 78.02 102.36 14.44 204.92 0.00 1 0.00 1 0 25 2.222e-01 7.691e-03 3.075e-02 1.162e-03 5.638500e-01 6.369032e-04 6.525398e-03 -6.000000e+00 1.343517e-01 228.03 -2.00 3.52 -2.00 320.36 0.00e+00 1.187116e-03 2.448100e-04 9.693172e-04 -6.000000e+00 6.014465e-03 286.35 -2.00 20.00 -2.00 319.70 0.00e+00 4.669 0.002 302.00 328.00 3 1.0640e+00 1.9509e-03 5.5289e-02 -6.0000e+00 3.3346e-01 -8.3878e-03 2.4504e-03 3.0191e-02 -6.0000e+00 3.6038e-01 -4.2986e-04 2.1901e-03 1.5287e-02 -6.0000e+00 2.1510e-01 -8.1562e-03 1.0985e-03 4.5299e-03 -6.0000e+00 9.1590e-02 9.7010e-04 -5.7412e-04 3.5206e-05 5.8706e-05 -6.0000e+00 6.6090e-03 3.3080e-03 -7.5557e-05 11 9 0 11 8 0 94.62 21.35 0.16 0.00331 -0.00101 301 72 1 5 0 160.440 25.79 19.99 21.35 21.39 39.7 1000.38 -69611 -81944 -60022 -82369 -136634 -78973 -57543 -61139 -47466 -58618 -40543 -45491 -28201 -32157 -15382 -13272 -14681 -6584 -12741 -5109 -8986 -5776 -5196 -5554 -6801 -3029 -7052 -7129 -8845 -9388 -1737 -1709 1056 -401 -6778 -3694 -3151 14 822 2079 176 1410 590 943 -67 2204 610 1433 -149 -104 1399 1634 1431 2047 204 1450 864 601 404 671 805 1925 1989 3086 1585 -724 108 -711 1241 1770 479 732 -63 98 -567 -1352 -816 -2603 -831 -678 -1078 -857 -1757 -1955 -275 -206 694 430 1386 767 467 256 -740 -333 731 61 -131 1053 564 -545 -613 -1757 -1964 187 153 -1496 -327 -877 -159 475 997 316 296 141 -338 -404 371 -139 720 409 -227 -379 730 39 956 442 -1441 469 925 217 315 -645 -669 -445 371 -175 -402 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