File name: Pandora206s1_BuffaloNY_20230909_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T061332.4Z 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_20230909_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: 20230909 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 20230909T132541.3Z 8652.559506 247 1 24.01 2 62.46 110.15 15.87 188.16 0.00 1 0.00 1 0 17 1.271e-01 1.901e-02 9.495e-02 1.540e-02 2.795382e-01 7.658548e-03 3.307287e-03 -6.000000e+00 7.169256e-02 229.62 -2.00 3.55 -2.00 318.21 0.00e+00 1.691085e-03 1.421868e-03 1.692194e-04 -6.000000e+00 3.187232e-03 285.92 -2.00 20.00 -2.00 317.41 0.00e+00 2.152 0.000 302.00 328.00 3 7.5186e+00 2.0730e-02 2.5715e-02 -6.0000e+00 1.7881e-01 7.2983e-02 2.3612e-02 1.4859e-02 -6.0000e+00 1.9401e-01 5.2747e-02 1.5240e-02 7.1587e-03 -6.0000e+00 1.1560e-01 -3.0284e-02 7.8591e-03 2.4109e-03 -6.0000e+00 4.9179e-02 2.3559e-05 -1.3052e-03 4.2999e-04 2.2489e-05 -6.0000e+00 3.2409e-03 -1.9650e-02 6.3210e-05 12 8 8 10 0 0 8.92 18.15 3.14 -0.01965 -0.02946 6 6 2 8 0 4000.000 15.00 18.15 26.63 21.58 21.69 19.2 988.82 -33449 84993 -5492 41957 -17564 69667 -32239 -18530 -3222 43430 6073 5564 -22675 2303 1177 -6633 30449 5792 6443 -2928 18150 -8585 8613 -4014 4924 -12442 12302 21 1527 10601 -9788 110 -2084 4860 -6162 7864 -1134 2817 4416 -5139 4087 -4348 3392 -1069 9849 -2943 -4623 1345 -681 369 1626 -547 1684 -87 3073 270 -364 299 -3014 -1213 -1340 6154 -1771 2268 -3233 -524 -2299 -3150 -18 -3252 3885 3024 3446 1707 4669 -1969 1399 -6223 -466 -4557 -1512 561 -3069 -49 -1212 174 1441 1601 -2405 2382 67 595 -1895 -496 -2183 -173 680 1927 692 1257 2516 -1375 -743 -2438 292 -1474 309 333 -1013 -550 2571 1258 -2427 -832 -1269 365 -198 -1683 305 682 -922 1530 696 266 1298 1233 -2075 477 1837 -778 1488 -2241 -230 -1544 -297 -36 1162 1802 940 8 341 -1419 -1269 -2794 2596 -420 1911 -1268 2058 -2702 -1508 -253 2370 459 429 -2648 244 147 -1009 3363 856 993 -516 2664 -1622 1394 -784 921 -2887 2265 4 283 1773 -2096 24 -492 1168 -1530 1626 -281 776 1395 -2121 1695 -2048 1535 -514 4233 -1447 -2280 611 -311 166 767 -285 905 -51 1788 164 -227 185 -1882 -737 -839 3849 -1309 1738 -2638 -381 -1580 -2118 -12 -2635 3232 2652 3012 1460 3610 -1503 930 -4212 -310 -3588 -1259 508 -3087 -50 -1333 203 1691 1938 -3053 2865 76 611 -1882 -466 -2206 -184 797 2494 938 1714 3173 -1657 -826 -2829 362 -1957 421 475 -1490 -859 4132 2080 -4011 -1259 -1821 481 -261 -2345 448 1065 -1447 2377 1066 390 1782 1671 -2744 614 2514 -1132 2236 -3602 -367 -2588 -524 -65 2106 3324 1764 15 620 -2525 -2190 SS 20230909T134817.5Z 8652.575203 258 1 9.08 2 58.65 114.90 17.06 205.05 0.00 1 0.00 1 0 17 9.389e-03 5.646e-03 2.767e-03 1.060e-03 2.430114e-01 5.275108e-04 2.952766e-03 -6.000000e+00 5.297272e-03 229.62 -2.00 3.55 -2.00 316.93 0.00e+00 3.148645e-04 6.944090e-05 5.331325e-05 -6.000000e+00 2.354285e-04 285.92 -2.00 20.00 -2.00 316.13 0.00e+00 1.915 0.000 302.00 328.00 3 2.5688e+00 1.3905e-03 2.2691e-02 -6.0000e+00 1.3212e-02 -1.2933e-02 1.5636e-03 1.2758e-02 -6.0000e+00 1.4335e-02 1.2868e-03 9.2084e-04 6.2165e-03 -6.0000e+00 8.5412e-03 -1.5230e-03 4.4372e-04 1.7312e-03 -6.0000e+00 3.6340e-03 4.7471e-03 3.3455e-06 2.9021e-05 1.8502e-05 -6.0000e+00 2.3939e-04 -1.9038e-02 1.3015e-04 12 1 1 12 1 1 98.41 18.15 0.29 -0.01904 -0.01901 58 95 1 8 0 148.830 15.00 18.15 27.88 21.58 21.69 19.4 997.20 -2075 -975 -1060 -2567 -4349 -3667 -2212 -1073 382 -249 -1665 -2221 -922 -605 343 -151 150 127 530 455 607 770 572 1070 -183 587 244 -73 -1026 512 644 841 1727 -364 -1639 -2034 -1674 -1227 -147 -514 -757 -464 -319 -744 -139 -354 -434 -303 -466 -144 886 754 865 1191 880 1200 922 626 484 487 839 1244 1375 1511 267 49 -222 -644 506 267 369 382 278 301 117 -232 -565 -575 -265 -694 -1024 -836 -2084 -1844 -1171 -723 -414 8 307 219 382 274 15 399 438 203 360 790 291 -268 -161 -584 -672 -123 -625 -748 -685 -529 -275 175 417 190 62 41 -30 266 139 293 150 132 -345 102 302 166 716 533 577 1028 687 441 387 60 -293 71 -62 -73 -104 114 -127 -296 -301 -422 -517 -292 -149 -167 -387 -578 -460 -290 -155 61 -43 -283 -381 -176 -131 76 -38 39 34 146 130 177 220 167 331 -60 199 84 -23 -305 147 196 273 605 -136 -569 -684 -618 -521 -74 -283 -457 -290 -206 -488 -90 -230 -276 -187 -282 -86 557 509 614 823 630 869 685 465 352 351 621 987 1185 1294 230 42 -175 -494 405 246 346 375 273 285 103 -198 -436 -453 -200 -597 -921 -832 -2241 -2059 -1305 -863 -519 9 373 274 438 308 15 391 454 234 429 980 385 -349 -209 -703 -758 -143 -805 -952 -911 -738 -400 254 639 295 92 60 -41 356 186 384 212 188 -507 147 453 238 964 733 750 1334 902 619 572 91 -428 108 -99 -116 -170 192 -216 -488 -507 -689 -824 SS 20230909T135333.3Z 8652.578857 260 1 28.57 2 57.78 116.06 17.49 208.62 0.00 1 0.00 1 0 25 1.000e-02 5.827e-03 3.974e-03 1.454e-03 2.394582e-01 7.257860e-04 2.912457e-03 -6.000000e+00 5.643526e-03 229.62 -2.00 3.55 -2.00 317.07 0.00e+00 4.353882e-04 9.858870e-05 5.426008e-05 -6.000000e+00 2.508073e-04 285.92 -2.00 20.00 -2.00 316.28 0.00e+00 1.869 0.000 302.00 328.00 3 4.2908e+00 1.9169e-03 2.2235e-02 -6.0000e+00 1.4076e-02 3.1359e-03 2.1537e-03 1.2602e-02 -6.0000e+00 1.5272e-02 2.0259e-04 1.2752e-03 6.1433e-03 -6.0000e+00 9.0994e-03 -2.3113e-03 6.1911e-04 1.7298e-03 -6.0000e+00 3.8716e-03 8.8463e-04 3.4470e-05 4.0030e-05 1.8757e-05 -6.0000e+00 2.5502e-04 -1.9165e-02 1.3619e-04 12 1 1 12 1 1 99.96 18.15 0.29 -0.01916 -0.01891 50 25 1 8 0 560.230 15.00 18.15 28.38 21.58 21.58 19.4 1000.71 -1975 -3009 -1014 -2246 -2492 -2959 -2868 -2226 1805 -1314 -1496 -2119 -798 -1370 690 495 240 734 867 1836 -158 595 246 686 -414 1101 -164 353 -1333 815 1046 850 1988 -380 -2385 -2469 -1942 -992 -380 -457 -698 -586 -431 -771 59 -282 -783 -610 -1044 61 732 937 820 1428 833 1080 565 718 513 620 1069 1115 1473 1702 381 -297 -154 -685 388 318 465 237 331 322 93 3 61 -523 -528 -721 -940 -1028 -1807 -1740 -1079 -811 -423 -262 204 205 495 385 123 172 428 69 543 755 276 -377 27 -778 -609 -52 -633 -900 -704 -650 -255 235 402 284 79 104 -129 141 146 157 198 96 -404 18 333 163 832 399 686 1070 781 368 447 -120 1 52 48 -145 -162 151 -67 -185 -358 -401 -666 -263 -445 -152 -320 -308 -349 -358 -308 269 -215 -239 -342 -142 -281 158 126 57 181 222 482 -43 159 67 198 -126 344 -52 115 -405 237 323 281 706 -131 -846 -845 -727 -386 -177 -252 -422 -337 -255 -463 35 -168 -500 -377 -632 36 458 627 530 970 587 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