File name: Pandora206s1_BuffaloNY_20240512_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240515T022658.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240512_L1_smca1c1d20220512p1-8.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: 20240512 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]: 305.0398 305.1808 305.3218 305.4628 305.6038 305.7447 305.8857 306.0266 306.1675 306.3084 306.4493 306.5902 306.7311 306.8720 307.0128 307.1537 307.2945 307.4353 307.5761 307.7169 307.8577 307.9985 308.1393 308.2800 308.4207 308.5615 308.7022 308.8429 308.9836 309.1243 309.2649 309.4056 309.5462 309.6869 309.8275 309.9681 310.1087 310.2493 310.3899 310.5305 310.6710 310.8116 310.9521 311.0926 311.2331 311.3736 311.5141 311.6546 311.7950 311.9355 312.0759 312.2164 312.3568 312.4972 312.6376 312.7779 312.9183 313.0587 313.1990 313.3394 313.4797 313.6200 313.7603 313.9006 314.0408 314.1811 314.3214 314.4616 314.6018 314.7421 314.8823 315.0225 315.1626 315.3028 315.4430 315.5831 315.7232 315.8634 316.0035 316.1436 316.2837 316.4238 316.5638 316.7039 316.8439 316.9839 317.1240 317.2640 317.4040 317.5439 317.6839 317.8239 317.9638 318.1038 318.2437 318.3836 318.5235 318.6634 318.8033 318.9431 319.0830 319.2228 319.3627 319.5025 319.6423 319.7821 319.9219 320.0616 320.2014 320.3412 320.4809 320.6206 320.7603 320.9000 321.0397 321.1794 321.3191 321.4587 321.5984 321.7380 321.8776 322.0172 322.1568 322.2964 322.4360 322.5755 322.7151 322.8546 322.9941 323.1336 323.2731 323.4126 323.5521 323.6916 323.8310 323.9705 324.1099 324.2493 324.3887 324.5281 324.6675 324.8069 324.9462 --------------------------------------------------------------------------------------- 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 20240512T131103.3Z 8898.549344 132 1 24.01 2 55.91 96.40 92.34 49.49 0.00 1 0.00 1 0 25 2.930e-01 2.430e-02 2.556e-01 1.948e-02 3.879178e-01 9.875714e-03 4.746494e-03 -6.000000e+00 1.672498e-01 230.73 -2.00 3.55 -2.00 319.03 0.00e+00 1.883228e-03 2.316425e-03 1.181077e-03 -6.000000e+00 7.419039e-03 281.08 -2.00 20.00 -2.00 318.34 0.00e+00 1.779 0.000 302.00 328.00 3 7.6974e+00 2.7529e-02 2.8094e-02 -6.0000e+00 4.2048e-01 1.0762e-01 3.1814e-02 2.2717e-02 -6.0000e+00 4.5660e-01 3.4617e-04 2.3787e-02 1.0163e-02 -6.0000e+00 2.6914e-01 -1.4102e-02 1.2612e-02 3.8755e-03 -6.0000e+00 1.1338e-01 2.2792e-05 7.1463e-04 5.4781e-04 3.2473e-05 -6.0000e+00 7.5655e-03 7.0593e-03 1.9656e-04 12 8 8 10 0 0 93.39 18.37 2.11 0.00706 0.01243 6 6 2 8 0 4000.000 15.00 18.37 18.93 21.79 21.79 21.9 1014.16 91 9006 124800 7314 27723 53608 40459 900000 31164 900000 203700 163384 -17868 109089 2769 493 45851 26732 -10519 3549 40452 2338 60496 1279 25376 16498 15596 -8688 -1721 -692 13569 2062 8706 14990 8850 29926 -16420 -2876 10540 8728 -10174 -5376 1479 -1741 -704 287 -12104 -13841 4776 -156 5341 -1672 -11602 4541 7101 73 4754 -606 -4310 -5090 -7634 8 -3012 1269 -1411 5052 -4013 -2727 2587 -2715 3303 4467 -1665 4449 5535 1474 2338 -3986 -19 83 -4082 2832 -2132 538 588 3404 2064 1650 -2805 -217 5 -691 1584 -704 -60 -1985 4034 -3504 4475 1883 -199 1511 -1964 -1881 2871 -2577 -249 1070 183 947 1016 -485 -2273 208 -2381 1178 -350 -266 -3424 -489 1099 -3892 1321 -934 3649 -1410 1131 740 1484 710 2306 -1010 210 296 -3024 1638 -773 835 1253 229 381 -1458 12 3 281 2370 237 667 1018 871 900000 927 900000 3868 3103 -1105 2348 198 42 2640 1981 -1161 367 2974 248 3791 150 2472 1839 1787 -1203 -208 -84 1579 299 1323 2277 1328 3618 -3360 -595 2312 2326 -3514 -1857 497 -614 -253 103 -4741 -5638 1615 -56 1963 -718 -5673 2084 3306 37 2365 -316 -2268 -2659 -4204 4 -1890 807 -938 3014 -2473 -1634 1564 -1989 2431 3386 -1334 3300 3746 926 1320 -2303 -11 56 -3284 2377 -1959 501 586 3531 2274 1880 -3351 -242 5 -674 1393 -619 -57 -2134 4586 -4683 5909 2500 -252 1768 -2189 -2144 3408 -3281 -324 1447 264 1467 1687 -811 -3873 324 -3501 1618 -487 -386 -5316 -781 1739 -6304 1975 -1407 4967 -1931 1430 952 2070 1081 3679 -1676 351 516 -5811 3153 -1551 1686 2526 448 711 -2645 22 SS 20240512T140622.5Z 8898.587761 164 1 26.02 2 46.02 107.56 84.52 58.40 0.00 1 0.00 1 0 17 1.502e-02 6.569e-03 1.442e-02 3.644e-03 2.900780e-01 1.816594e-03 3.505426e-03 -6.000000e+00 8.504608e-03 230.73 -2.00 3.55 -2.00 317.73 0.00e+00 -1.920964e-04 2.883006e-04 8.034701e-05 -6.000000e+00 3.690115e-04 281.09 -2.00 20.00 -2.00 317.01 0.00e+00 1.438 0.000 302.00 328.00 3 5.8299e+00 4.8655e-03 2.1077e-02 -6.0000e+00 2.1304e-02 1.8814e-02 5.4886e-03 1.5277e-02 -6.0000e+00 2.3115e-02 -1.0097e-03 3.3999e-03 7.4768e-03 -6.0000e+00 1.3721e-02 -2.7545e-03 1.7122e-03 2.0628e-03 -6.0000e+00 5.7964e-03 2.5438e-04 -4.0377e-05 1.0063e-04 2.1568e-05 -6.0000e+00 3.8296e-04 9.2936e-03 -2.6302e-05 11 8 0 10 0 0 99.75 18.36 0.45 0.00929 0.00899 17 17 2 8 0 1530.240 15.00 18.36 20.97 21.79 21.79 21.9 1027.27 -6827 1403 4747 177 1419 3004 -515 1900 2446 3640 1346 216 -3316 -1423 -915 -2185 1487 2369 -194 1732 3479 -1260 1229 3054 -311 -4060 -494 33 -4311 296 1284 1121 1453 1380 -2816 -3962 -2603 -986 405 -402 -423 -1444 -254 -1382 -384 -386 -2131 -3926 -735 -440 927 274 542 2123 986 1235 1452 761 752 897 4 1898 1246 1729 270 427 -433 -922 324 211 1461 102 639 606 409 -612 -532 -793 -527 -476 -1382 -421 -1741 -1464 -783 -542 -30 -267 342 -1 547 159 669 62 564 202 452 709 352 -210 -256 -558 -803 -540 -348 -769 -514 -677 -545 143 648 980 -115 107 -186 74 -481 -209 -197 61 -361 -442 287 119 658 466 938 957 522 428 436 290 -87 -150 198 -52 -511 225 -83 -272 -251 -43 -443 -605 127 429 16 109 217 -41 166 240 378 141 23 -418 -203 -149 -403 276 454 -40 362 731 -273 266 695 -77 -1092 -130 8 -1008 65 301 284 402 400 -784 -1077 -769 -332 163 -179 -207 -744 -134 -742 -202 -204 -1125 -2057 -367 -219 485 156 324 1325 645 819 984 517 498 586 3 1357 978 1454 231 333 -317 -661 243 182 1276 94 585 534 358 -484 -379 -536 -373 -383 -1263 -395 -1770 -1544 -881 -653 -35 -327 417 -1 627 167 686 62 555 221 550 901 477 -280 -319 -684 -918 -638 -449 -982 -684 -948 -800 223 1004 1534 -175 161 -256 101 -663 -282 -285 94 -567 -683 429 170 943 639 1211 1243 735 606 652 447 -137 -245 323 -89 -901 404 -149 -477 -423 -74 -743 SS 20240512T141156.5Z 8898.591627 167 1 27.08 2 45.05 108.82 83.69 59.26 0.00 1 0.00 1 0 17 1.063e-02 5.582e-03 3.991e-03 1.267e-03 2.782444e-01 6.335986e-04 3.342767e-03 -6.000000e+00 6.022165e-03 230.73 -2.00 3.55 -2.00 317.29 0.00e+00 5.398742e-04 9.034130e-05 6.380994e-05 -6.000000e+00 2.612817e-04 281.09 -2.00 20.00 -2.00 316.59 0.00e+00 1.414 0.000 302.00 328.00 3 4.0767e+00 1.6824e-03 2.0385e-02 -6.0000e+00 1.5085e-02 5.0696e-03 1.8901e-03 1.4584e-02 -6.0000e+00 1.6368e-02 -2.0103e-03 1.1387e-03 7.1272e-03 -6.0000e+00 9.7156e-03 -1.9982e-03 5.6103e-04 2.0167e-03 -6.0000e+00 4.1046e-03 1.5430e-03 2.3830e-04 3.4758e-05 2.0924e-05 -6.0000e+00 2.7116e-04 9.2573e-03 -1.6319e-05 10 0 0 10 0 0 99.96 18.36 0.29 0.00926 0.01105 58 58 2 8 0 466.740 15.00 18.36 21.39 21.79 21.79 22.2 1031.54 -344 -2357 -53 -3577 -2773 -5985 -799 -2192 -741 -864 -2180 -2568 -1342 -758 -117 629 -243 662 -34 1594 424 239 166 667 -190 849 -503 -422 -887 265 1946 550 2010 -671 -1662 -2764 -1651 -1663 -153 -614 -525 -764 -603 -678 -352 -248 -622 -379 -516 282 302 1062 841 1420 731 1220 921 688 664 237 1166 1202 1698 1485 513 -580 -286 -784 3 125 512 357 309 453 -137 -34 -187 -776 -404 -492 -1112 -798 -2011 -1572 -1148 -770 -391 -105 334 56 587 175 298 178 605 121 530 632 168 -255 84 -620 -657 74 -739 -738 -677 -449 -369 157 400 246 110 167 -192 159 -50 359 77 104 -182 -126 271 230 807 285 674 971 500 228 287 54 -194 95 100 67 -154 134 -207 -278 -215 -416 -469 -37 -284 -6 -426 -285 -605 -82 -254 -95 -118 -296 -355 -208 -135 -24 141 -52 147 -8 379 104 58 41 175 -53 243 -147 -115 -246 72 558 172 617 -221 -508 -908 -538 -627 -68 -327 -280 -425 -347 -394 -202 -143 -353 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