File name: Pandora206s1_BuffaloNY_20240721_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T084745.5Z 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_20240721_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: 20240721 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 20240721T111307.5Z 8968.467448 190 1 45.33 2 77.80 73.49 105.05 249.03 0.00 1 0.00 1 0 25 3.559e-01 1.547e-02 2.419e-01 8.168e-03 6.462289e-01 4.438580e-03 7.360139e-03 -6.000000e+00 2.054956e-01 232.74 -2.00 3.55 -2.00 321.17 0.00e+00 3.701257e-03 2.110786e-03 9.800610e-04 -6.000000e+00 9.797070e-03 287.46 -2.00 20.00 -2.00 320.53 0.00e+00 4.592 0.002 302.00 328.00 3 4.4402e+00 1.5306e-02 5.7250e-02 -6.0000e+00 5.1729e-01 1.8270e-01 2.0524e-02 3.5460e-02 -6.0000e+00 5.6137e-01 -2.6364e-01 1.9419e-02 1.8656e-02 -6.0000e+00 3.3275e-01 9.9516e-02 9.3000e-03 6.9324e-03 -6.0000e+00 1.4106e-01 3.3574e-05 -3.5115e-04 2.2751e-04 7.5858e-05 -6.0000e+00 9.3086e-03 -1.0144e-02 1.8244e-04 12 8 8 10 0 0 94.97 17.54 1.02 -0.01014 -0.01278 18 6 2 8 0 2517.860 14.99 17.54 26.77 20.46 20.67 23.3 993.86 -219491 900000 -86307 900000 -131585 900000 -101562 -109503 -94376 900000 29044 10858 -129133 -38319 900000 -67579 900000 -9650 28932 -41190 900000 -68202 24183 9416 -39385 -22745 -6136 -30174 -49055 80274 -34768 13617 -4679 81305 19919 34686 -27520 28842 40461 13098 11710 -8958 13696 -2681 19683 564 14989 -4471 11604 1305 12543 8464 -18110 7474 5074 5960 4284 6048 -800 6051 -9099 16570 -820 7158 -879 5061 2419 140 5712 -2085 5118 1666 3420 1889 4524 -681 10002 -5066 -1090 -3165 -1772 1826 -724 -1418 -5255 2686 -190 562 -2215 1126 -1040 2303 142 -922 -1999 -2832 487 469 615 -670 719 -1767 -201 -3373 1019 -2371 -1268 526 -301 871 511 108 -1907 2573 -1493 1136 -1011 83 -482 1069 -158 634 -413 -402 2432 -148 762 247 1233 152 1293 -355 381 -974 258 81 -76 166 -154 257 -189 -656 -532 -6024 900000 -831 900000 -1708 900000 -1021 -1330 -1106 900000 231 86 -3352 -513 900000 -1839 900000 -182 400 -1207 900000 -2627 385 189 -1369 -705 -164 -985 -1869 958 -1499 451 -206 1725 731 1073 -1671 1236 1895 921 936 -938 1204 -284 1775 60 1477 -522 1272 160 1619 1205 -3662 1277 939 1130 852 1172 -160 1174 -2011 3303 -210 1915 -267 1390 675 41 1743 -802 2021 709 1409 743 1578 -223 2895 -1724 -380 -1348 -868 989 -440 -912 -3775 1906 -146 439 -1781 840 -733 1467 89 -599 -1478 -2452 448 497 708 -773 764 -1733 -186 -3270 1030 -2474 -1382 606 -382 1225 762 170 -3054 3788 -2261 1603 -1477 125 -748 1701 -251 1009 -644 -601 3385 -204 1002 342 1927 256 2360 -702 781 -2049 577 191 -181 406 -375 594 -412 -1422 -1116 SS 20240721T111826.8Z 8968.471143 192 1 46.31 2 76.87 74.34 105.91 249.83 0.00 1 0.00 1 0 25 2.864e-01 8.451e-03 2.592e-01 4.974e-03 6.218042e-01 2.620963e-03 7.001258e-03 -6.000000e+00 1.632842e-01 232.74 -2.00 3.55 -2.00 320.98 0.00e+00 6.748251e-04 1.162631e-03 4.349484e-04 -6.000000e+00 7.230622e-03 287.46 -2.00 20.00 -2.00 320.31 0.00e+00 4.288 0.001 302.00 328.00 3 3.8805e+00 8.6100e-03 5.4039e-02 -6.0000e+00 4.1016e-01 6.5726e-02 1.1537e-02 3.4112e-02 -6.0000e+00 4.4399e-01 -1.1248e-01 1.1132e-02 1.7142e-02 -6.0000e+00 2.6409e-01 3.4943e-02 5.4033e-03 5.3739e-03 -6.0000e+00 1.1165e-01 8.2297e-05 -1.3386e-04 1.3507e-04 5.3280e-05 -6.0000e+00 7.3109e-03 -1.0338e-02 1.6058e-04 11 8 0 10 0 0 26.58 17.54 0.73 -0.01034 -0.01134 37 11 2 8 0 1251.510 15.00 17.54 27.05 20.46 20.67 23.4 995.73 -208063 29538 -90180 35119 -9302 74723 15337 -109443 -48365 -38578 -4207 -75422 -88578 -65026 21251 -37327 45558 -5704 2374 -9076 67981 -30606 -24864 3377 63127 -30182 -26158 484 -27699 5343 -12188 17894 -559 22216 -10783 -12042 -6820 11332 -157 -1383 -5683 -14617 1406 -3460 -5100 272 -105 -3027 3417 1959 3788 4314 841 1015 3273 7084 1877 4784 -712 2434 -2013 4591 180 2573 1619 1754 -320 -737 2212 -108 2508 1746 1500 -301 1705 91 1353 -1393 -747 -1833 -269 -135 -2899 -2654 -1722 1208 175 2018 672 -1062 536 912 238 555 152 -831 870 577 199 -205 -130 -630 -767 -1233 -209 -1563 -1063 -487 -909 -33 548 -119 -192 -82 -683 593 -229 355 -130 142 -147 416 -105 214 1335 467 1192 155 623 499 210 142 -508 -552 118 247 -79 368 235 -38 -159 -602 -381 -4221 143 -716 170 -45 362 74 -1274 -352 -281 -22 -915 -1547 -1136 196 -742 442 -102 43 -194 692 -831 -675 77 857 -1113 -952 13 -941 140 -455 582 -26 873 -554 -619 -374 616 -12 -129 -623 -1872 162 -426 -643 33 -13 -399 441 273 581 737 162 214 718 1557 451 1111 -169 550 -491 1156 54 848 562 582 -107 -255 819 -43 1085 794 675 -130 725 35 480 -511 -305 -902 -138 -79 -1907 -1835 -1270 926 142 1654 559 -861 395 626 157 375 116 -740 878 671 252 -256 -152 -667 -741 -1223 -223 -1780 -1270 -621 -1268 -47 853 -196 -314 -128 -1009 826 -325 528 -207 235 -241 652 -161 313 2017 687 1672 231 957 857 395 284 -1067 -1228 260 569 -185 879 560 -86 -372 -1332 -818 SS 20240721T112412.9Z 8968.475149 195 1 45.60 2 75.85 75.26 106.85 250.69 0.00 1 0.00 1 0 25 2.819e-01 8.103e-03 1.136e-01 3.624e-03 5.790835e-01 1.895565e-03 6.605020e-03 -6.000000e+00 1.606711e-01 232.74 -2.00 3.55 -2.00 320.76 0.00e+00 1.618385e-03 7.853960e-04 7.462232e-04 -6.000000e+00 7.115545e-03 287.46 -2.00 20.00 -2.00 320.07 0.00e+00 4.000 0.001 302.00 328.00 3 3.6337e+00 6.0838e-03 5.0346e-02 -6.0000e+00 4.0360e-01 3.3345e-02 7.8435e-03 3.1493e-02 -6.0000e+00 4.3690e-01 -9.2303e-02 7.2248e-03 1.5973e-02 -6.0000e+00 2.5987e-01 2.8560e-02 3.5748e-03 4.9425e-03 -6.0000e+00 1.0986e-01 1.4594e-04 -9.5692e-05 9.9861e-05 5.4346e-05 -6.0000e+00 7.1951e-03 -9.8034e-03 1.5279e-04 11 8 0 10 0 0 58.25 17.54 0.59 -0.00980 -0.01052 57 18 2 8 0 799.960 15.00 17.54 27.46 20.46 20.67 23.4 998.98 -183059 -92640 -96089 -60009 -95747 -54789 -84561 -89134 -95300 -42325 2535 -66665 -44019 -46184 -14684 -39567 5633 -16645 2740 -11038 17802 -22885 -18796 -14299 -13101 -6972 -23033 -5921 -30715 -340 -14097 -12189 -12687 -9171 -7620 -7754 -4337 4089 8923 1267 1578 -4552 4092 -4722 2840 -933 2136 770 4360 978 4936 4059 1177 2206 1191 2763 1221 2642 -1037 2332 -3107 3944 1602 2760 341 1467 -64 336 5051 3526 3327 763 1194 -164 1005 -1358 128 -2265 -164 -629 -1312 -584 -2096 -1443 -1114 399 -223 368 5 464 454 522 -20 259 36 -868 317 137 -27 -573 -38 -854 -308 -1107 -217 -1981 -977 -1133 -256 1 322 174 -75 431 -73 567 -251 171 -683 171 -55 694 474 355 817 461 791 853 864 98 456 -123 -89 -279 127 -135 4 158 -108 -326 -70 -402 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