File name: Pandora206s1_BuffaloNY_20240831_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T090952.2Z 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_20240831_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: 20240831 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 20240831T140616.8Z 9009.587695 207 1 24.01 2 53.86 115.86 28.30 133.09 0.00 1 0.00 1 0 17 7.252e-02 1.894e-02 5.230e-02 1.329e-02 2.523223e-01 6.659125e-03 3.026338e-03 -6.000000e+00 4.111172e-02 230.33 -2.00 3.55 -2.00 317.62 0.00e+00 -8.287402e-04 1.031973e-03 4.013713e-04 -6.000000e+00 1.824258e-03 286.58 -2.00 20.00 -2.00 316.80 0.00e+00 1.691 0.000 302.00 328.00 3 7.8198e+00 1.7745e-02 2.1262e-02 -6.0000e+00 1.0270e-01 6.2565e-02 2.0057e-02 1.3169e-02 -6.0000e+00 1.1126e-01 2.9224e-02 1.2365e-02 6.4618e-03 -6.0000e+00 6.6289e-02 -1.6042e-02 6.1917e-03 1.8223e-03 -6.0000e+00 2.8258e-02 2.8709e-05 -6.6125e-04 3.7089e-04 1.8351e-05 -6.0000e+00 1.8488e-03 -3.6291e-02 1.1188e-04 12 8 8 10 0 0 -66.32 17.56 0.37 -0.03629 -0.04126 6 6 2 8 0 4000.000 15.00 17.56 26.38 20.35 19.96 24.0 978.48 -19951 29701 3499 8369 26321 21229 20788 25998 13850 21137 -22622 -9866 -22911 3663 4017 3732 23317 6923 6228 -2006 9280 -4359 2951 9623 6963 -12516 -974 -5834 -1038 4047 454 1134 2740 1672 -5311 3217 -8794 855 8135 3778 4051 -2552 187 -1766 1064 -1688 -44 -8064 -3162 -2254 -1600 -969 -17 -1910 1586 -484 -752 3754 1313 -4395 -2310 3558 -653 2104 274 -1818 -1327 -1893 -673 -1678 1180 1981 2252 1340 4633 450 3662 -4181 -1630 -2127 -3574 3233 -1605 -3889 -581 3164 1014 1962 837 352 713 103 1435 -1498 439 -4239 848 1046 1285 577 1761 669 -1161 -2867 520 -59 -59 1147 -859 -348 432 511 -2094 93 -749 158 -1593 -254 -1828 -228 610 -771 1081 -764 1987 -3000 -790 1484 2207 -1080 765 947 191 -2079 1507 982 -1106 1916 1172 -45 -122 -1547 -501 -2231 2250 359 783 1849 1465 1521 2022 1378 2121 -3372 -1283 -3759 525 653 680 3763 1315 1241 -450 1913 -1017 648 2181 1712 -3787 -267 -1637 -253 900 110 293 754 494 -1566 822 -2754 279 2976 1671 1982 -1392 102 -998 579 -943 -24 -4563 -1718 -1200 -888 -575 -10 -1237 1030 -326 -520 2483 897 -3032 -1642 2546 -512 1728 232 -1442 -992 -1370 -498 -1387 1052 1839 2098 1218 3937 357 2521 -2900 -1125 -1661 -3185 2983 -1619 -4166 -644 3639 1256 2417 1053 444 827 109 1412 -1435 431 -4653 980 1345 1768 788 2232 791 -1336 -3415 638 -77 -80 1611 -1248 -533 696 838 -3402 142 -1052 203 -2132 -338 -2641 -348 951 -1201 1619 -1115 2745 -4156 -1009 1831 2888 -1560 1107 1410 290 -3324 2472 1709 -1952 3359 2096 -82 -212 -2646 -822 SS 20240831T141557.5Z 9009.594416 214 1 46.21 2 52.28 118.11 27.09 137.07 0.00 1 0.00 1 0 17 8.571e-03 5.604e-03 7.267e-04 3.185e-04 2.204471e-01 1.601053e-04 2.699417e-03 -6.000000e+00 4.858046e-03 230.33 -2.00 3.55 -2.00 316.58 0.00e+00 3.437445e-04 1.921182e-05 3.771567e-05 -6.000000e+00 2.155811e-04 286.58 -2.00 20.00 -2.00 315.79 0.00e+00 1.631 0.000 302.00 328.00 3 2.1458e+00 4.2063e-04 1.9813e-02 -6.0000e+00 1.2136e-02 -3.1409e-02 4.7060e-04 1.1639e-02 -6.0000e+00 1.3148e-02 3.2695e-03 2.7378e-04 5.6622e-03 -6.0000e+00 7.8336e-03 -2.0092e-03 1.2970e-04 1.5774e-03 -6.0000e+00 3.3387e-03 9.9018e-03 -4.3397e-05 8.7547e-06 1.7507e-05 -6.0000e+00 2.1849e-04 -3.4864e-02 1.2970e-04 10 0 0 10 0 0 94.96 17.56 0.32 -0.03486 -0.03519 638 197 1 8 0 71.860 14.99 17.56 26.91 20.35 19.96 24.3 983.36 -1350 -1077 -491 -2242 -3474 -2689 -1778 50 302 133 -2143 -1520 -1038 -472 251 240 -78 277 630 1088 992 70 982 496 331 474 424 -152 -635 316 1436 876 1919 252 -2046 -1937 -1776 -1107 -452 -151 -767 -621 -626 -666 -164 -352 -466 -313 -739 -162 850 714 833 975 713 923 943 605 563 476 942 1096 1248 1577 338 -143 -204 -481 398 443 176 294 36 442 112 -3 -153 -705 -111 -652 -985 -944 -1928 -1621 -1128 -766 -405 -306 349 196 412 300 230 577 584 230 386 758 144 -252 -236 -511 -577 70 -591 -816 -719 -655 -319 134 277 160 169 103 12 183 272 277 197 136 -300 -91 158 240 663 508 530 1188 767 488 308 71 -114 84 0 -55 -222 125 -194 -320 -234 -481 -464 -226 -199 -93 -412 -560 -401 -276 8 57 27 -436 -304 -228 -117 64 68 -23 83 196 349 326 23 321 173 121 179 163 -55 -212 101 475 310 724 102 -784 -702 -700 -498 -222 -88 -495 -416 -433 -467 -114 -244 -318 -206 -475 -102 556 502 567 700 531 694 726 467 425 357 720 896 1105 1385 302 -127 -165 -376 320 407 167 292 36 428 101 -3 -121 -565 -90 -555 -945 -931 -2059 -1793 -1243 -908 -506 -370 425 247 478 340 237 561 593 258 448 976 187 -323 -304 -610 -643 80 -745 -1091 -939 -897 -454 189 414 243 247 149 16 239 352 373 268 200 -456 -137 232 338 877 685 675 1488 1031 658 437 104 -170 129 0 -89 -370 212 -316 -540 -381 -760 -715 SS 20240831T142043.3Z 9009.597723 216 1 46.22 2 51.52 119.26 26.53 139.14 0.00 1 0.00 1 0 17 8.345e-03 5.578e-03 6.724e-04 2.942e-04 2.166899e-01 1.480264e-04 2.654087e-03 -6.000000e+00 4.730210e-03 230.33 -2.00 3.55 -2.00 316.59 0.00e+00 3.089922e-04 1.785445e-05 3.976891e-05 -6.000000e+00 2.099079e-04 286.58 -2.00 20.00 -2.00 315.80 0.00e+00 1.603 0.000 302.00 328.00 3 1.9863e+00 3.8856e-04 1.9480e-02 -6.0000e+00 1.1816e-02 -3.1264e-02 4.3486e-04 1.1432e-02 -6.0000e+00 1.2802e-02 2.9424e-03 2.5290e-04 5.5747e-03 -6.0000e+00 7.6274e-03 -1.9155e-03 1.1945e-04 1.5547e-03 -6.0000e+00 3.2508e-03 1.2006e-02 -3.8423e-05 8.0840e-06 1.7073e-05 -6.0000e+00 2.1274e-04 -3.4855e-02 1.3219e-04 10 0 0 10 0 0 98.13 17.57 0.31 -0.03486 -0.03514 871 269 2 8 0 52.630 15.00 17.57 27.48 20.35 19.96 24.4 987.79 -1450 -987 -767 -2227 -3288 -2430 -1528 -373 343 -293 -1534 -1688 -770 -691 422 73 16 267 572 1083 756 319 843 755 257 588 237 -12 -866 673 1302 985 1744 123 -2111 -1967 -1746 -1139 -372 -206 -682 -704 -542 -788 -231 -406 -368 -331 -668 -225 790 715 806 1034 674 974 875 656 525 476 831 1081 1222 1578 343 -152 -208 -587 463 360 230 247 90 389 156 -122 -134 -773 -156 -617 -978 -860 -1979 -1580 -1182 -752 -440 -278 275 188 338 336 185 532 583 200 383 739 168 -260 -187 -597 -556 24 -635 -836 -702 -647 -357 162 299 188 137 116 -21 240 218 318 169 139 -334 -69 228 258 667 528 486 1150 784 456 360 57 -79 85 -29 -63 -226 91 -149 -335 -242 -456 -486 -245 -183 -147 -411 -530 -362 -237 -63 65 -60 -311 -338 -169 -172 107 20 5 80 176 344 247 103 274 260 93 220 90 -4 -286 211 425 343 649 49 -796 -701 -676 -504 -196 -118 -432 -463 -368 -543 -157 -277 -245 -213 -420 -139 505 491 581 785 531 715 657 494 420 377 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