File name: Pandora206s1_BuffaloNY_20221115_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T043750.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: ---- 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_v2d20211008.txt Instrument calibration file used: Pandora206s1_CF_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20221115_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: 20221115 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 20221115T163225.5Z 8354.689184 345 1 30.64 2 61.92 172.65 73.57 283.87 0.00 1 0.00 1 0 17 1.030e-02 5.601e-03 4.393e-03 1.460e-03 2.545603e-01 7.110613e-04 3.110016e-03 -6.000000e+00 5.638054e-03 222.72 -2.00 3.55 -2.00 317.25 0.00e+00 2.957438e-04 1.000175e-04 5.910155e-05 -6.000000e+00 2.492320e-04 277.73 -2.00 20.00 -2.00 316.60 0.00e+00 2.114 0.000 302.00 328.00 3 4.1741e+00 1.8576e-03 2.4251e-02 -6.0000e+00 1.3878e-02 1.3503e-02 2.0983e-03 1.2932e-02 -6.0000e+00 1.5178e-02 -2.8674e-04 1.2684e-03 6.4354e-03 -6.0000e+00 9.0488e-03 -2.5904e-03 6.3080e-04 1.8565e-03 -6.0000e+00 3.8587e-03 7.7757e-04 1.9139e-04 4.0432e-05 1.9963e-05 -6.0000e+00 2.6260e-04 9.2891e-03 -9.6820e-07 10 0 0 10 0 0 99.94 17.76 0.42 0.00929 0.01073 52 52 2 8 0 589.130 15.01 17.76 10.33 21.38 21.17 13.1 914.92 -920 -714 -509 -3803 -2584 -3575 181 -2875 -2587 -2357 -3307 -1686 -2261 -901 -145 568 -260 2126 328 1678 354 177 887 63 88 609 113 -743 -608 -317 1458 1053 960 -516 -1725 -2115 -1852 -853 -111 -15 -534 -362 -820 -694 -354 -391 -939 -383 -1225 -88 715 819 891 826 709 989 898 887 975 683 1176 1151 1729 1726 223 -170 -459 -577 506 311 583 136 384 331 -21 134 -476 -832 -221 -776 -961 -1290 -2038 -1304 -1061 -765 -212 103 196 344 353 286 77 115 402 36 716 698 13 -120 -455 -655 -543 28 -763 -712 -834 -474 -141 320 346 309 106 3 -109 41 -118 99 172 -7 -138 34 313 400 905 349 616 858 593 293 103 181 -244 118 61 -62 46 116 -101 -129 -395 -496 -570 -108 -90 -65 -459 -269 -370 19 -358 -359 -340 -466 -243 -375 -169 -31 131 -62 518 84 442 95 47 242 19 27 193 36 -218 -165 -86 420 326 326 -179 -552 -680 -665 -322 -50 -8 -304 -213 -501 -424 -215 -237 -558 -220 -698 -50 432 529 606 544 479 678 628 613 658 461 823 873 1419 1505 192 -133 -339 -419 396 278 564 126 351 313 -19 104 -370 -624 -162 -653 -905 -1242 -2087 -1387 -1217 -935 -250 125 237 424 399 295 79 116 404 40 886 891 17 -154 -590 -782 -616 34 -938 -913 -1123 -667 -208 470 532 476 155 4 -145 52 -151 133 250 -11 -214 52 466 564 1205 479 802 1147 797 420 156 279 -384 180 100 -107 80 207 -180 -222 -658 -799 -904 SS 20221115T164419.6Z 8354.697449 350 1 30.53 2 61.70 175.84 75.63 285.66 0.00 1 0.00 1 0 17 1.534e-02 6.604e-03 9.807e-03 3.281e-03 2.536699e-01 1.589541e-03 3.096510e-03 -6.000000e+00 8.398655e-03 222.72 -2.00 3.55 -2.00 317.19 0.00e+00 7.975783e-04 2.229548e-04 5.445556e-05 -6.000000e+00 3.712489e-04 277.73 -2.00 20.00 -2.00 316.54 0.00e+00 2.099 0.000 302.00 328.00 3 5.7998e+00 4.1548e-03 2.4114e-02 -6.0000e+00 2.0673e-02 3.2439e-02 4.6982e-03 1.2920e-02 -6.0000e+00 2.2609e-02 5.8505e-03 2.8340e-03 6.4228e-03 -6.0000e+00 1.3479e-02 -6.1401e-03 1.4063e-03 1.9386e-03 -6.0000e+00 5.7484e-03 1.5323e-04 1.2792e-04 9.0267e-05 2.0147e-05 -6.0000e+00 3.9115e-04 8.6320e-03 -8.1710e-06 11 8 0 10 0 0 99.98 17.77 0.23 0.00863 0.00959 9 9 1 8 0 3391.970 15.01 17.77 11.00 21.27 21.17 13.1 919.27 -2440 3071 -12717 1583 -2834 -874 -210 571 -805 1249 -3503 -872 -2 -154 993 -1796 2288 -434 2145 77 3245 -842 2582 -754 1494 -2057 -43 2062 -938 7 283 1263 1256 613 -2756 -679 -2352 -35 33 111 -804 -1007 -11 -1281 -448 -763 -1361 -1697 357 -567 1056 -33 455 1135 36 865 709 556 357 563 814 2002 1790 1867 81 -234 -1155 -107 453 346 800 200 607 287 1063 -818 -362 -211 -762 -1576 -750 -761 -2296 -1291 -949 -90 -114 246 94 849 243 819 -13 -646 -372 355 674 642 193 -109 -92 -1213 -562 -544 -520 -1255 -623 -534 266 233 689 496 -11 -166 -386 231 -444 428 -327 184 130 310 164 94 275 164 765 619 630 189 608 223 195 -267 105 -151 78 157 42 -354 -261 -543 -492 -289 372 -1836 186 -305 -90 -23 70 -112 177 -504 -127 0 -28 208 -423 533 -108 542 21 848 -225 690 -221 447 -662 -14 584 -254 2 82 389 424 210 -888 -215 -844 -14 16 59 -461 -599 -7 -769 -273 -467 -817 -996 202 -325 639 -21 303 793 26 615 514 399 257 404 607 1558 1482 1641 70 -190 -888 -82 365 311 758 192 589 267 924 -662 -272 -157 -594 -1373 -707 -772 -2435 -1385 -1071 -108 -139 308 118 1025 276 864 -13 -640 -387 397 818 827 260 -142 -113 -1460 -639 -657 -656 -1665 -842 -739 384 352 1067 769 -16 -236 -527 297 -582 587 -467 272 193 462 239 133 376 219 986 803 862 270 888 335 297 -418 171 -252 132 270 72 -599 -435 -873 -795 SS 20221115T171555.7Z 8354.719395 366 1 7.03 2 61.72 184.34 81.02 290.44 0.00 1 0.00 1 0 17 1.160e-02 5.719e-03 2.892e-03 1.036e-03 2.538465e-01 5.022061e-04 3.102266e-03 -6.000000e+00 6.352108e-03 222.72 -2.00 3.55 -2.00 317.12 0.00e+00 2.847459e-04 6.911896e-05 6.281691e-05 -6.000000e+00 2.808065e-04 277.73 -2.00 20.00 -2.00 316.47 0.00e+00 2.100 0.000 302.00 328.00 3 2.1047e+00 1.3110e-03 2.4123e-02 -6.0000e+00 1.5635e-02 1.3961e-03 1.4826e-03 1.2903e-02 -6.0000e+00 1.7100e-02 -1.8295e-03 8.8861e-04 6.4142e-03 -6.0000e+00 1.0195e-02 -1.6405e-03 4.3755e-04 1.8387e-03 -6.0000e+00 4.3472e-03 6.2857e-03 6.6085e-05 2.8492e-05 1.9713e-05 -6.0000e+00 2.9591e-04 9.0434e-03 -3.4637e-05 12 1 1 12 1 1 94.56 17.80 0.33 0.00904 0.00954 67 150 1 8 0 99.470 15.02 17.80 11.36 21.38 21.17 13.0 919.93 -3333 -2213 -2033 -4290 -4082 -4862 -1858 -1988 -329 -2137 -3112 -2317 -997 -571 499 342 -179 382 428 2841 689 173 626 471 288 702 -118 -450 -375 761 2304 564 1691 -603 -2127 -2619 -1526 -939 195 -204 -811 -591 -457 -582 -9 -177 -631 -479 -902 -91 1251 938 1123 980 724 1005 802 529 420 550 995 1545 1564 1451 75 -234 -673 -512 625 292 500 176 54 411 11 79 -719 -628 -485 -941 -964 -1020 -1882 -1451 -1040 -746 -376 -79 198 210 573 75 508 337 519 76 547 645 -5 -353 -222 -657 -661 96 -742 -733 -687 -523 -230 255 366 213 251 19 -123 197 -56 365 155 24 -158 192 233 601 686 297 753 916 500 507 95 75 -135 126 -76 -223 70 81 -170 -124 -238 -467 -710 -442 -314 -292 -575 -477 -563 -226 -272 -49 -340 -484 -372 -181 -118 106 79 -43 95 111 742 186 46 172 138 88 223 -37 -132 -102 227 661 176 572 -211 -686 -851 -549 -392 97 -109 -470 -354 -282 -360 -6 -109 -379 -280 -520 -53 764 614 773 714 500 704 574 375 316 412 714 1195 1316 1299 66 -188 -510 -380 500 268 460 168 51 370 10 63 -571 -479 -397 -814 -932 -1011 -1987 -1597 -1150 -879 -463 -100 249 251 668 80 496 324 539 88 655 858 -6 -475 -279 -759 -779 111 -951 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