File name: Pandora206s1_BuffaloNY_20240204_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T073000.6Z 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_20240204_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: 20240204 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 20240204T143415.6Z 8800.607125 227 1 24.01 2 71.53 135.64 74.84 210.47 0.00 1 0.00 1 0 17 6.062e-01 4.202e-02 3.392e-01 2.740e-02 4.460312e-01 1.395608e-02 5.760454e-03 -6.000000e+00 3.388795e-01 224.26 -2.00 3.55 -2.00 319.81 0.00e+00 4.334104e-03 4.066726e-03 3.232631e-03 -6.000000e+00 1.673597e-02 272.40 -2.00 20.00 -2.00 319.32 0.00e+00 3.118 0.001 302.00 328.00 3 7.1610e+00 3.9518e-02 4.1829e-02 -6.0000e+00 8.4050e-01 1.3039e-01 4.6768e-02 3.3450e-02 -6.0000e+00 9.2040e-01 -8.9868e-03 4.0730e-02 1.1800e-02 -6.0000e+00 5.4457e-01 8.0228e-03 2.1569e-02 6.3548e-03 -6.0000e+00 2.3330e-01 1.0376e-05 1.4562e-04 7.8613e-04 3.8541e-05 -6.0000e+00 1.6049e-02 -4.6089e-03 1.5848e-04 12 8 8 10 0 0 89.93 17.54 0.36 -0.00461 -0.00351 6 6 2 8 0 4000.000 14.99 17.54 7.23 21.17 20.96 19.5 957.17 -111588 900000 147635 900000 112133 900000 31015 22047 155330 900000 900000 220621 900000 83261 900000 -28312 900000 17190 -4828 -19042 436179 28339 160294 31364 10393 54234 -16415 241733 -39844 161472 95705 55107 -27305 38583 -14601 41189 1167 7677 15963 -22007 6347 -2475 90071 -8066 48393 -9102 -15203 -30450 14535 -13477 -93 6255 -6529 17824 9614 7643 -4380 7050 -2002 195 -7692 10963 -7129 7084 -10223 44953 -8222 -9013 9021 -5705 8883 -8206 12144 3492 7116 -3266 2036 -3316 -6301 -3432 -3940 6210 7252 2372 -6404 7363 -3395 334 4371 8510 -4695 639 978 -2801 -4785 -222 1698 -469 2040 -677 5670 -3663 3208 -6310 4436 -2162 -2168 -135 41 1117 -239 25 -5648 255 -3377 5237 -4069 2888 -3483 1280 -492 -70 -957 -828 2500 -349 3302 3617 2456 -54 4866 -227 749 -1071 1148 -1654 565 381 62 -128 35 176 -2776 -5117 900000 3939 900000 2992 900000 828 588 4144 900000 900000 5886 900000 2222 900000 -1841 900000 858 -310 -1477 11638 1415 4277 1674 716 2605 -1519 6450 -4252 4308 3522 3333 -4007 3188 -1838 3013 142 986 2289 -5302 1307 -586 9148 -2094 7664 -2527 -4500 -10242 3260 -4135 -27 1883 -2318 5484 3335 2759 -1823 2586 -781 74 -3277 4250 -3585 3509 -5918 14430 -4319 -4772 4332 -3547 5377 -5918 7260 2154 3874 -1756 956 -1617 -3473 -2143 -2822 4510 5587 2004 -6146 6778 -3530 344 4311 7919 -4576 544 777 -2312 -4429 -222 1892 -585 2640 -875 6604 -4236 3193 -7151 4916 -2674 -2813 -182 57 1684 -393 42 -9754 390 -4948 6878 -5913 4098 -5454 2004 -780 -110 -1479 -1218 3377 -465 4167 4560 3465 -85 7806 -399 1337 -1977 2212 -3419 1159 799 129 -255 69 328 -5173 SS 20240204T143916.5Z 8800.610608 229 1 26.79 2 70.90 136.72 75.31 211.50 0.00 1 0.00 1 0 17 3.066e-01 7.188e-03 2.125e-01 6.504e-03 4.586930e-01 3.221181e-03 5.400791e-03 -6.000000e+00 1.690622e-01 224.26 -2.00 3.55 -2.00 319.79 0.00e+00 9.594462e-04 9.395862e-04 3.640403e-04 -6.000000e+00 7.265471e-03 272.40 -2.00 20.00 -2.00 319.28 0.00e+00 3.021 0.000 302.00 328.00 3 5.3054e+00 9.0950e-03 3.7798e-02 -6.0000e+00 4.1832e-01 4.3269e-02 1.0843e-02 2.3878e-02 -6.0000e+00 4.5706e-01 1.8298e-02 9.5997e-03 1.2036e-02 -6.0000e+00 2.7133e-01 -1.7854e-02 5.0791e-03 3.7099e-03 -6.0000e+00 1.1509e-01 7.6755e-05 -4.2895e-04 1.8097e-04 3.8312e-05 -6.0000e+00 7.8109e-03 -4.6726e-03 6.4593e-05 11 8 0 10 0 0 99.96 17.54 0.27 -0.00467 -0.00790 17 17 2 8 0 1575.650 15.00 17.54 7.33 21.17 20.96 19.6 958.27 23123 128980 -688 10808 -8520 27083 13193 87374 -20237 102461 276999 111572 -561 12546 8245 -22103 3792 -7906 -9368 -598 8371 -13836 14833 3762 10008 -2444 2976 6005 -4159 -1235 7562 -2221 3220 2700 1322 -1435 -7077 1151 1099 838 -4696 -1123 722 -540 3470 4685 -1807 -3202 2726 -2229 -2579 -700 -176 649 1344 557 -487 -1046 -353 -1594 -46 1749 -513 1740 -2338 1098 -106 1034 490 -484 1814 961 922 1513 804 192 -1059 -1082 -984 -1422 1642 -305 -2819 -1293 -1481 -1299 1201 -105 481 1085 590 121 740 262 168 590 93 1334 104 333 42 -392 -1048 -652 -896 -886 -425 -640 86 81 730 492 112 -91 -823 844 -195 316 -238 -104 -749 -500 179 167 626 -200 673 431 686 397 474 -381 -716 -224 -125 -397 496 88 272 -39 149 -395 -81 235 818 -11 144 -122 278 170 633 -458 789 1757 859 -15 361 290 -1226 176 -446 -573 -35 462 -946 798 247 659 -193 227 420 -305 -92 591 -217 339 302 139 -154 -896 158 180 164 -1079 -263 173 -133 827 1119 -461 -833 680 -606 -773 -226 -61 240 516 222 -201 -432 -140 -634 -19 762 -255 905 -1288 564 -53 515 267 -299 1199 665 631 975 493 105 -542 -546 -544 -921 1143 -244 -2413 -1140 -1407 -1317 1243 -113 514 1101 553 108 619 221 156 600 108 1678 141 439 51 -453 -1124 -721 -1083 -1121 -545 -874 126 126 1180 819 187 -143 -1247 1192 -281 474 -373 -171 -1233 -796 283 252 896 -285 907 602 1032 635 813 -688 -1301 -424 -253 -823 1035 189 580 -79 297 -755 -155 SS 20240204T144918.9Z 8800.617580 231 1 15.47 2 69.66 138.92 76.29 213.54 0.00 1 0.00 1 0 17 6.251e-02 6.237e-03 7.354e-02 5.376e-03 4.306539e-01 2.649311e-03 5.109855e-03 -6.000000e+00 3.445691e-02 224.26 -2.00 3.55 -2.00 319.38 0.00e+00 1.120643e-03 6.808445e-04 3.210216e-04 -6.000000e+00 1.480931e-03 272.40 -2.00 20.00 -2.00 318.85 0.00e+00 2.848 0.000 302.00 328.00 3 4.8016e+00 7.3415e-03 3.5548e-02 -6.0000e+00 8.5259e-02 3.2875e-02 8.5740e-03 2.2344e-02 -6.0000e+00 9.3166e-02 4.4910e-03 6.9797e-03 1.1196e-02 -6.0000e+00 5.5308e-02 -1.1677e-02 3.7224e-03 3.4855e-03 -6.0000e+00 2.3452e-02 1.5672e-04 -4.6129e-04 1.4858e-04 3.4395e-05 -6.0000e+00 1.5929e-03 -3.9265e-03 -1.1737e-05 12 1 1 12 1 1 99.99 17.55 0.40 -0.00393 -0.00739 10 19 2 8 0 1405.450 15.00 17.55 7.60 21.17 20.96 19.6 960.53 -30796 1704 -33976 18013 -19300 -1532 -24981 2333 -24629 2531 4556 25344 -11994 2902 -4843 2467 -3934 1743 -5235 -2675 6883 -1059 9409 3115 6224 -4624 -164 -1079 364 -1786 -304 55 -1267 2282 -5371 -115 -3554 2253 -1332 1880 -2971 -232 -1835 973 -25 348 -3851 -1969 2431 -970 527 -33 1338 3448 1354 187 1001 -658 -149 39 1049 -1944 434 1622 155 1078 -1420 404 927 189 1088 926 763 642 -103 -340 -557 -940 -554 -844 -591 -581 -2907 -995 -873 -175 740 -125 530 273 441 973 594 -141 539 -51 732 713 690 -132 -158 -899 -691 444 -930 -1000 -295 -934 -550 -138 439 -59 411 14 -600 586 -193 -38 -133 34 -155 -220 266 158 904 267 430 1031 333 231 579 -286 -646 433 -133 -265 -91 102 -71 -123 146 -194 -251 -774 35 -1054 315 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