File name: Pandora64s1_NewHavenCT_20240525_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240526T050813.4Z 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 v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240525_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: 20240525 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 20240525T101022.9Z 8911.423876 198 1 47.72 2 83.06 67.96 88.00 227.38 0.00 1 0.00 1 0 25 9.198e-01 5.443e-02 2.664e-01 1.362e-02 9.201847e-01 8.138995e-03 1.594571e-02 -6.000000e+00 5.640267e-01 231.75 -2.00 3.52 -2.00 321.79 0.00e+00 7.874580e-02 3.551562e-03 1.251580e-03 -6.000000e+00 2.470474e-02 284.48 -2.00 20.00 -2.00 321.32 0.00e+00 7.576 0.008 302.00 328.00 3 1.1227e+00 2.7893e-02 1.1356e-01 -6.0000e+00 1.4136e+00 2.1691e+00 3.0965e-02 1.4848e-01 -6.0000e+00 1.5237e+00 -2.4651e+00 1.5976e-02 2.4255e-02 -6.0000e+00 9.0555e-01 9.6311e-01 9.3999e-03 6.2314e-02 -6.0000e+00 3.8243e-01 1.9491e-05 -5.1342e-03 3.4540e-04 1.1187e-03 -6.0000e+00 2.7397e-02 -1.4501e-03 -8.1276e-05 12 8 8 10 0 0 38.59 21.52 0.08 -0.00145 -0.04003 24 6 1 5 0 1987.980 26.00 20.00 21.52 23.67 39.3 1030.57 187875 418270 261085 285965 -46326 175836 91076 36164 113871 -2420 -3771 121874 18868 36577 162827 78433 146187 209789 141587 212920 206132 295657 900000 119671 46170 31051 70833 -46284 53166 -59114 97452 52215 125652 96878 130085 49140 259618 32120 72065 21415 95074 31426 101070 -15409 30956 50476 200915 58201 108982 -13153 147913 56976 302105 42172 84298 17838 68094 -14842 67371 11955 61252 29968 53044 41463 90001 27563 45906 41457 42625 30929 35149 9222 6355 7203 -636 -5952 41829 1771 -6650 18558 1699 -30950 4598 2792 -4305 -5590 -2713 -122 -2235 10019 -11406 5249 -22936 -13177 -16016 616 -5479 2676 647 3286 -701 4220 -11650 424 -6968 -7763 -8024 7468 -6063 -636 968 -351 -3470 -188 -3900 -3971 95 3111 1510 6248 1640 5443 3621 6001 5509 1981 -2278 1606 1371 724 1617 900 134 -1110 279 -514 -559 -631 1811 -338 -700 -3582 12474 5554 9789 6924 -17532 6318 4502 2001 2268 -110 -153 1922 1211 3157 5978 7565 8520 7374 9087 6486 5988 3926 900000 3178 1731 1116 1705 -3449 1910 -8015 4415 4353 5987 5978 5182 3685 3447 2559 3715 1790 3945 2357 4362 -2057 2832 4416 4502 5546 6555 -2509 7120 6305 4012 5351 6782 2355 5212 -2256 4631 1429 5311 3935 6496 6546 9772 5205 7281 6942 7547 6708 7442 2333 1608 1610 -136 -1212 5587 371 -1771 5011 599 -16192 1886 1200 -2073 -2821 -1373 -61 -1129 4285 -5628 2087 -12054 -6916 -9836 393 -4474 2370 636 3109 -639 3219 -9367 302 -5658 -6649 -7490 6624 -7061 -773 1305 -509 -5266 -272 -5689 -5770 139 4663 2422 9656 2551 7706 5028 7843 7026 2579 -3096 2348 2373 1385 3432 2083 334 -2855 751 -1440 -1575 -1791 4913 -879 -1773 -8690 SS 20240525T102100.1Z 8911.431251 201 1 48.34 2 81.20 69.62 89.43 229.11 0.00 1 0.00 1 0 25 4.542e-01 2.583e-02 1.308e-01 3.682e-03 8.494668e-01 2.166099e-03 1.081797e-02 -6.000000e+00 2.785792e-01 231.75 -2.00 3.52 -2.00 321.69 0.00e+00 2.436030e-02 1.183818e-03 5.279383e-03 -6.000000e+00 1.219943e-02 284.48 -2.00 20.00 -2.00 321.19 0.00e+00 6.175 0.004 302.00 328.00 3 1.0569e+00 7.9459e-03 7.7960e-02 -6.0000e+00 6.9820e-01 7.1052e-01 1.0420e-02 4.7415e-02 -6.0000e+00 7.5252e-01 -9.6816e-01 9.3399e-03 3.1523e-02 -6.0000e+00 4.4724e-01 4.0472e-01 4.3719e-03 2.2842e-02 -6.0000e+00 1.8882e-01 1.4177e-04 -2.2020e-03 1.0069e-04 4.1462e-04 -6.0000e+00 1.3523e-02 -2.3070e-03 -5.4136e-05 12 8 8 10 0 0 49.00 21.54 0.16 -0.00231 -0.01885 101 24 1 5 0 478.570 26.00 20.00 21.54 24.19 39.1 1032.68 -125695 -78815 -82088 -92353 -269004 -92470 -137816 -127120 -104428 -87228 -125656 -65587 -80120 -31731 -38099 -43675 -26520 84456 6685 47362 15282 143430 63910 56135 -39128 -13916 -21029 -14480 -17391 -33397 1792 44756 29844 45118 23859 18640 38478 27068 40512 28109 37060 31617 33296 18014 33299 41375 47944 40971 31297 19276 43450 19129 44971 24897 27062 16561 17683 13617 24474 15229 16102 16970 25039 24520 27500 13721 18845 14825 14222 10129 10420 6612 7087 4118 3986 -526 4182 -1582 -954 3906 1756 -4796 -115 -2250 -1056 -1686 -957 -1399 1175 -69 -1930 -2233 -4969 -5884 -3702 -3120 -3293 106 294 -223 -712 -1983 -4888 -2343 -1978 -3428 -2687 -2019 -1831 -896 -251 -463 -658 -270 -923 -785 231 570 1358 2193 1514 1716 2098 2749 2503 2093 -739 1292 2093 804 1122 -39 -243 -175 411 -389 -537 256 206 -678 -684 -2131 -2462 -1080 -1206 -1356 -18512 -1087 -2384 -1909 -1227 -940 -1887 -754 -1360 -456 -759 -1112 -641 819 133 697 269 721 688 625 -983 -268 -432 -312 -386 -1068 52 1008 896 1178 716 596 1093 972 1455 1275 1645 1569 1728 1129 1869 2255 2582 2541 2288 1737 3446 1946 4139 2726 2931 1997 2085 1618 2780 1777 2014 2402 3768 4196 4756 2714 3676 3172 3443 2867 3099 2057 2084 1148 1002 -127 963 -422 -303 1314 703 -2334 -58 -1215 -601 -1013 -593 -882 714 -41 -1082 -1214 -2804 -3697 -2674 -2468 -3053 109 320 -239 -712 -1795 -4240 -2043 -1832 -3373 -2843 -2329 -2229 -1231 -380 -738 -1059 -422 -1406 -1183 357 920 2283 3678 2464 2657 3138 3929 3490 2869 -1044 1990 3704 1527 2348 -84 -556 -428 1063 -986 -1378 657 547 -1706 -1611 -4795 SS 20240525T103346.2Z 8911.440118 206 1 48.35 2 78.94 71.58 91.20 231.15 0.00 1 0.00 1 0 17 5.506e-01 1.137e-02 5.306e-02 1.502e-03 7.256665e-01 8.565013e-04 8.299958e-03 -6.000000e+00 3.377613e-01 231.75 -2.00 3.52 -2.00 321.04 0.00e+00 3.484174e-03 4.023577e-04 2.349566e-03 -6.000000e+00 1.479043e-02 284.49 -2.00 20.00 -2.00 320.48 0.00e+00 5.024 0.002 302.00 328.00 3 9.3540e-01 2.8419e-03 6.4491e-02 -6.0000e+00 8.4652e-01 7.0512e-02 3.8585e-03 4.1097e-02 -6.0000e+00 9.1235e-01 -1.2243e-01 3.8122e-03 2.2284e-02 -6.0000e+00 5.4224e-01 4.6835e-02 1.8176e-03 7.4911e-03 -6.0000e+00 2.2896e-01 6.3448e-04 -7.9154e-04 4.2904e-05 1.0797e-04 -6.0000e+00 1.6394e-02 -2.7905e-03 -4.2177e-05 12 8 8 10 0 0 -2.24 21.57 0.17 -0.00279 -0.00874 254 61 1 5 0 190.330 26.00 20.00 21.57 24.60 39.2 1034.97 -198728 -188747 -156838 -192312 -283152 -169373 -166628 -166263 -139932 -138180 -134327 -109891 -92025 -95709 -49210 -76094 -46375 -34509 -42360 -23644 -25061 -21976 -20170 -21919 -29423 -30173 -22188 -28596 -27743 -33428 -12253 -6223 -1237 -4757 -10443 -7041 -3279 -134 -1009 4402 4071 4384 4611 287 4873 5076 6170 6339 4020 2293 6237 7185 7848 6567 4915 4444 3632 2702 3281 2188 3817 3135 4464 5598 3747 664 1527 966 1859 3266 1651 1977 760 312 -454 -1699 -844 -2834 -881 -163 -1395 -1583 -1922 -2400 -858 -625 273 538 1448 556 -49 -209 -1567 -814 -65 42 -623 883 502 -434 -643 -1987 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