File name: Pandora206s1_BuffaloNY_20240502_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T081402.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240502_L1_smca1c4d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20240502 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: None First and last pixel inside fitting window: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0744 305.2154 305.3564 305.4973 305.6383 305.7792 305.9201 306.0611 306.2020 306.3428 306.4837 306.6246 306.7654 306.9063 307.0471 307.1879 307.3287 307.4695 307.6103 307.7511 307.8918 308.0326 308.1733 308.3140 308.4548 308.5955 308.7362 308.8768 309.0175 309.1582 309.2988 309.4394 309.5801 309.7207 309.8613 310.0019 310.1424 310.2830 310.4236 310.5641 310.7046 310.8451 310.9857 311.1261 311.2666 311.4071 311.5476 311.6880 311.8285 311.9689 312.1093 312.2497 312.3901 312.5305 312.6708 312.8112 312.9515 313.0919 313.2322 313.3725 313.5128 313.6531 313.7934 313.9336 314.0739 314.2141 314.3543 314.4946 314.6348 314.7750 314.9151 315.0553 315.1955 315.3356 315.4758 315.6159 315.7560 315.8961 316.0362 316.1763 316.3163 316.4564 316.5964 316.7364 316.8765 317.0165 317.1565 317.2964 317.4364 317.5764 317.7163 317.8563 317.9962 318.1361 318.2760 318.4159 318.5558 318.6956 318.8355 318.9753 319.1152 319.2550 319.3948 319.5346 319.6744 319.8141 319.9539 320.0937 320.2334 320.3731 320.5128 320.6525 320.7922 320.9319 321.0716 321.2112 321.3509 321.4905 321.6301 321.7697 321.9093 322.0489 322.1885 322.3280 322.4676 322.6071 322.7467 322.8862 323.0257 323.1652 323.3046 323.4441 323.5836 323.7230 323.8624 324.0018 324.1413 324.2806 324.4200 324.5594 324.6988 324.8381 324.9774 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20240502T105341.6Z 8888.453953 107 1 45.75 2 82.72 75.44 64.52 154.84 0.00 1 0.00 1 0 17 5.279e-01 1.528e-02 3.558e-01 8.524e-03 9.618692e-01 5.040001e-03 1.033171e-02 -6.000000e+00 3.052845e-01 229.83 -2.00 3.55 -2.00 322.39 0.00e+00 1.097751e-02 3.084785e-03 5.736308e-03 -6.000000e+00 1.393723e-02 279.93 -2.00 20.00 -2.00 321.95 0.00e+00 7.282 0.007 302.00 328.00 3 1.0825e+00 2.0797e-02 1.0181e-01 -6.0000e+00 7.6610e-01 8.1376e-01 3.1326e-02 9.0524e-02 -6.0000e+00 8.3434e-01 -1.0978e+00 3.2982e-02 3.3901e-02 -6.0000e+00 4.8973e-01 4.3913e-01 1.4811e-02 1.5480e-02 -6.0000e+00 2.0515e-01 5.3907e-05 -1.0664e-03 2.3129e-04 1.5438e-04 -6.0000e+00 1.3981e-02 -1.6250e-02 1.7971e-04 12 8 8 10 0 0 63.40 18.48 0.66 -0.01625 -0.02426 96 30 4 8 0 476.480 15.00 18.48 18.15 21.88 21.88 21.6 1018.65 -230115 -126991 -167406 900000 -238289 900000 -162436 900000 900000 -24005 -122544 -109758 -184538 -160 -81976 -118542 63577 -86531 900000 -50919 900000 -87457 3386 -80093 900000 -64997 -44154 -54321 -122164 900000 -35820 12453 -16208 91515 43357 19063 -31590 79676 36748 68477 38 13197 -535 -14140 34420 -29170 35034 -33649 51566 11400 5270 25364 42735 21394 34737 14196 15822 13285 -2612 11546 -7177 23292 9430 23354 7168 26059 6650 18303 15770 7678 14308 963 11523 819 13033 -2359 -6568 -5674 6055 -2812 4075 722 4580 -96 843 2102 2490 7184 -2218 3797 -1866 2061 2982 -2375 -1677 -1260 341 -933 -1781 -629 -399 -2181 -1654 -3719 -239 -3995 -779 -1316 -904 -2287 48 -806 -949 -546 -402 -944 -1144 -318 -202 888 921 1301 1365 2056 44 2425 1116 926 1263 -1186 931 384 419 138 -375 29 6 589 650 -682 264 -974 -1426 -4167 -1054 -2021 900000 -4675 900000 -1348 900000 900000 -199 -1017 -911 -3203 -1 -928 -2415 528 -1632 900000 -730 900000 -1650 28 -1450 900000 -1133 -623 -812 -3226 900000 -654 176 -363 760 540 285 -839 794 671 1080 1 427 -21 -645 971 -1598 1047 -2123 1498 539 302 1347 2093 1421 2134 1096 1221 1025 -223 824 -631 1682 916 2326 916 2747 872 2263 2225 1370 2636 209 2190 159 1990 -370 -1019 -923 1035 -654 1062 228 1555 -36 334 874 1075 3029 -1025 1588 -767 772 1099 -994 -820 -741 215 -708 -1522 -536 -318 -1567 -1141 -2578 -172 -2870 -576 -1074 -830 -2491 59 -1098 -1336 -759 -538 -1233 -1529 -445 -298 1332 1334 1762 1774 2566 54 2845 1294 1157 1873 -2109 1837 835 978 347 -1025 82 17 1717 1879 -1876 663 -2283 -3197 SS 20240502T110608.4Z 8888.462598 110 1 46.05 2 80.50 77.48 63.59 157.89 0.00 1 0.00 1 0 17 7.169e-01 1.106e-02 1.229e-01 2.891e-03 7.999597e-01 1.568420e-03 8.797733e-03 -6.000000e+00 4.046354e-01 229.83 -2.00 3.55 -2.00 321.81 0.00e+00 3.741273e-03 8.606718e-04 1.493799e-03 -6.000000e+00 1.752771e-02 279.93 -2.00 20.00 -2.00 321.34 0.00e+00 5.773 0.004 302.00 328.00 3 1.0195e+00 5.8041e-03 7.1864e-02 -6.0000e+00 1.0118e+00 2.3536e-01 8.6722e-03 4.5529e-02 -6.0000e+00 1.0987e+00 -3.4954e-01 9.3601e-03 2.5155e-02 -6.0000e+00 6.5224e-01 1.3767e-01 4.2880e-03 9.4703e-03 -6.0000e+00 2.7580e-01 2.9983e-04 -3.3080e-04 7.6444e-05 1.1494e-04 -6.0000e+00 1.8273e-02 -1.7151e-02 2.0164e-04 12 8 8 10 0 0 -3.20 18.48 0.38 -0.01715 -0.01964 254 78 2 8 0 180.550 15.00 18.48 18.75 21.88 21.88 21.7 1023.69 -217196 -240911 -199750 -252516 -228009 -273836 -161541 -208253 -189863 -212229 -190646 -214832 -186513 -98834 -117103 -92852 -106924 -78683 -82275 -58077 -47224 -67147 -69632 -40475 -41235 -46223 -48234 -33529 -79302 -59525 -24455 -3873 -10773 -21773 -7428 -26624 -3078 -4435 17862 5527 10412 1032 10363 12012 16000 16804 3872 2472 674 14502 9604 12812 10012 15779 8880 8836 10176 11412 3128 1535 5915 5974 10677 7234 8042 4036 4160 4037 5695 4711 5926 3841 2771 2108 2084 1437 -582 -2854 -1349 -336 -777 1579 -1172 -1607 -1682 -851 15 91 708 612 485 -988 -17 -1528 -663 -1223 -468 -525 -99 -443 -77 -1363 -1763 -1250 -1947 -1519 -1032 -314 -1216 -96 77 387 16 222 -546 -194 -346 296 118 105 275 613 902 471 1094 480 751 566 566 203 306 156 -171 -25 -100 140 19 161 -7 -143 -115 -342 -737 -1503 -2532 -1536 -3236 -2045 -3790 -865 -1996 -1713 -2633 -1989 -3271 -2839 -836 -1552 -1204 -1839 -1154 -1369 -802 -599 -1022 -1139 -548 -605 -756 -830 -482 -1766 -1208 -441 -70 -249 -620 -174 -736 -75 -129 514 220 449 53 511 599 776 834 226 154 46 932 739 1087 965 1588 1026 1066 1257 1383 396 192 729 817 1613 1313 1558 800 833 849 1310 1166 1610 1111 798 571 561 346 -134 -698 -374 -113 -282 650 -550 -801 -899 -482 9 55 425 353 260 -506 -8 -809 -400 -877 -391 -513 -106 -477 -77 -1238 -1434 -1012 -1723 -1408 -1007 -330 -1432 -128 116 573 24 354 -838 -284 -517 461 195 165 460 969 1372 693 1538 659 995 796 926 350 587 322 -376 -59 -253 372 53 440 -18 -369 -276 -772 -1603 SS 20240502T111607.8Z 8888.469535 115 1 46.07 2 78.71 79.12 62.92 160.39 0.00 1 0.00 1 0 17 4.946e-01 6.621e-03 6.823e-02 1.561e-03 6.968451e-01 8.350832e-04 7.800709e-03 -6.000000e+00 2.791965e-01 229.83 -2.00 3.55 -2.00 321.29 0.00e+00 2.559188e-03 3.981079e-04 1.145599e-03 -6.000000e+00 1.209281e-02 279.93 -2.00 20.00 -2.00 320.76 0.00e+00 4.935 0.002 302.00 328.00 3 9.0886e-01 2.8121e-03 6.1476e-02 -6.0000e+00 6.9813e-01 7.5710e-02 3.9596e-03 3.8593e-02 -6.0000e+00 7.5809e-01 -1.1589e-01 4.1941e-03 2.1093e-02 -6.0000e+00 4.5004e-01 3.7967e-02 1.9944e-03 7.6473e-03 -6.0000e+00 1.9032e-01 8.1824e-04 1.8110e-05 4.1771e-05 8.5199e-05 -6.0000e+00 1.2607e-02 -1.7514e-02 2.1432e-04 11 8 0 10 0 0 7.17 18.48 0.34 -0.01751 -0.01738 437 135 2 8 0 104.930 15.00 18.48 19.77 21.88 21.88 21.9 1030.54 -153397 -181013 -132651 -155418 -161493 -186174 -166612 -166685 -141157 -128896 -142317 -106311 -132866 -76313 -84939 -30004 -62492 -28532 -47719 -32974 -26564 -32830 -35447 -30464 -26365 -26374 -26340 -31475 -31193 -30471 -16614 -16652 -7832 -12494 -10908 -19008 -9384 -8730 -2336 1114 836 1419 129 1228 1259 3230 257 -239 1501 1720 2847 3308 3162 3468 3518 3353 3459 2213 1923 2128 1840 2917 4027 4564 2737 2385 1352 877 1797 2337 1816 1972 907 773 359 119 -1082 -1494 -469 -1210 -974 -822 -1607 -1744 -994 -549 329 -119 677 694 787 -3 -318 -423 -395 -270 3 683 -72 -8 -365 -532 -1092 -423 -1164 -880 -1011 -572 -569 205 240 196 312 -86 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