File name: Pandora206s1_BuffaloNY_20240418_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240419T051613.5Z 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_20240418_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: 20240418 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 20240418T115922.2Z 8874.499563 172 1 24.01 2 74.27 89.38 118.24 333.43 0.00 1 0.00 1 0 17 3.959e-01 1.017e-02 2.970e-01 9.558e-03 5.937704e-01 5.020049e-03 6.657532e-03 -6.000000e+00 2.245349e-01 228.59 -2.00 3.55 -2.00 320.46 0.00e+00 3.022851e-03 1.872826e-03 4.654293e-04 -6.000000e+00 1.099473e-02 278.34 -2.00 20.00 -2.00 319.91 0.00e+00 3.623 0.001 302.00 328.00 3 5.0129e+00 1.5100e-02 4.7488e-02 -6.0000e+00 5.6246e-01 1.0749e-01 1.9291e-02 3.1625e-02 -6.0000e+00 6.1228e-01 -3.2647e-02 1.9229e-02 1.7139e-02 -6.0000e+00 3.6067e-01 5.3786e-04 9.7203e-03 7.8065e-03 -6.0000e+00 1.5460e-01 4.6828e-05 2.0049e-03 2.6132e-04 6.7248e-05 -6.0000e+00 1.0698e-02 7.3457e-03 3.9947e-04 12 8 8 10 0 0 100.00 18.16 0.70 0.00735 0.02241 6 6 2 8 0 4000.000 15.01 18.16 15.64 21.69 21.58 21.3 1009.42 -96081 -69817 900000 900000 900000 -84155 276608 900000 53680 900000 900000 60676 -56134 133128 -19827 36946 196774 -10427 -18752 -21974 43895 -5350 169384 -5854 22570 16369 6070 -28290 3264 -25355 35714 15113 -15223 -13755 -2649 -3798 -13376 7500 19828 12022 -15143 -1305 239 1352 20128 -8135 -10869 -17594 8939 -2152 2133 -1657 -331 -299 10847 3644 2718 -2164 -1055 -2105 3789 963 -543 4455 217 3328 -1628 2208 640 -736 998 2280 226 576 182 -1689 1788 57 -3631 -2394 -40 -295 -666 -2010 -93 -171 2121 -804 -216 1270 439 16 183 382 -3407 299 810 957 -165 345 68 -476 172 -208 172 -1055 -650 799 -803 104 -434 232 -818 -110 13 474 -196 203 539 529 -618 -1134 95 100 1287 252 623 1195 222 -187 500 50 -517 -338 36 -67 -199 346 126 386 0 -917 19 -922 -650 900000 900000 900000 -833 2575 900000 500 900000 900000 565 -931 1239 -369 473 1832 -267 -567 -729 779 -154 1577 -194 604 495 210 -1333 108 -1195 1091 668 -1031 -1001 -168 -238 -1024 548 1575 1214 -2264 -182 35 199 2476 -1361 -1901 -3376 1367 -388 410 -369 -79 -78 2678 999 777 -647 -302 -598 1045 300 -195 1665 89 1297 -633 868 271 -366 540 1270 127 304 88 -763 722 23 -1717 -1288 -24 -200 -493 -1583 -77 -147 1866 -748 -200 1110 367 12 140 295 -2956 279 866 1139 -209 440 81 -529 172 -212 190 -1235 -775 1004 -1081 155 -694 386 -1359 -174 19 676 -284 306 838 858 -1004 -1776 146 147 1833 350 824 1633 336 -309 890 92 -997 -667 76 -145 -437 772 281 835 0 -1834 36 SS 20240418T145722.3Z 8874.623175 268 1 24.01 2 43.54 126.71 120.40 21.14 0.00 1 0.00 1 0 17 2.141e-02 1.161e-02 3.297e-02 9.299e-03 2.651294e-01 4.612731e-03 3.156505e-03 -6.000000e+00 1.201606e-02 228.60 -2.00 3.55 -2.00 317.53 0.00e+00 -7.837177e-04 6.885551e-04 7.726388e-05 -6.000000e+00 5.201102e-04 278.36 -2.00 20.00 -2.00 316.86 0.00e+00 1.378 0.000 302.00 328.00 3 7.3960e+00 1.2250e-02 1.9426e-02 -6.0000e+00 2.9973e-02 5.4648e-02 1.3813e-02 1.3663e-02 -6.0000e+00 3.2597e-02 1.5428e-02 8.4822e-03 6.7401e-03 -6.0000e+00 1.9351e-02 -1.4487e-02 4.2400e-03 1.9706e-03 -6.0000e+00 8.1858e-03 5.7986e-05 -1.7406e-04 2.5711e-04 1.9656e-05 -6.0000e+00 5.4573e-04 1.3363e-02 -8.4714e-05 12 8 8 10 0 0 -186.27 18.16 0.72 0.01336 0.01205 6 6 2 8 0 4000.000 15.00 18.16 16.01 21.69 21.58 21.5 1012.81 -1990 -3633 9074 537 3744 -2704 2646 1412 190 6735 0 -1539 -3557 5896 -883 4064 1393 7988 958 -1316 1703 231 -289 -1052 -3348 -1537 3002 944 952 -3192 2034 4755 2523 -3776 410 -1531 -168 -3517 394 -446 -2701 -2614 2932 -1473 3372 255 -4515 -5018 -159 -993 579 590 -2498 1569 -1157 -144 1672 -196 803 -1426 -67 2777 1300 2842 -12 222 -1642 -1722 464 -1372 2031 583 1596 1700 2021 1001 -604 1441 -2293 -1036 -1528 -104 -2803 -1737 99 73 1262 716 1245 1405 639 -873 -157 -1933 -1358 -1622 1129 1435 1156 654 174 -1360 -1017 -464 357 -801 -442 -1996 -902 1166 1258 425 -692 -721 -1156 -562 -662 -1217 -570 62 1121 -250 882 453 1315 -656 -620 790 199 -477 -72 240 777 -31 325 1191 524 446 168 531 -655 -1633 -770 -190 -387 905 55 320 -237 235 143 22 781 0 -192 -510 877 -160 779 284 1580 211 -308 395 53 -69 -271 -929 -437 821 245 226 -775 500 1218 721 -1195 114 -435 -50 -1263 164 -215 -1457 -1463 1600 -844 1823 142 -2577 -2795 -85 -536 326 347 -1593 1017 -795 -99 1161 -138 544 -976 -47 2014 1040 2396 -11 173 -1215 -1278 347 -1195 1873 551 1487 1566 1720 791 -437 965 -1670 -844 -1361 -101 -2891 -1844 110 88 1528 898 1559 1729 727 -947 -154 -1863 -1383 -1832 1337 1831 1565 865 222 -1622 -1164 -549 446 -1061 -609 -2844 -1330 1796 1988 683 -1077 -1070 -1620 -732 -863 -1668 -834 93 1701 -378 1286 651 1768 -883 -788 997 272 -679 -108 366 1196 -49 540 2058 904 789 299 937 -1126 -2729 -1244 SS 20240418T155828.1Z 8874.665603 304 1 24.00 2 35.86 147.00 115.41 36.26 0.00 1 0.00 1 0 17 3.453e-02 1.331e-02 2.717e-02 9.447e-03 2.368820e-01 4.678199e-03 2.861482e-03 -6.000000e+00 1.939148e-02 228.60 -2.00 3.55 -2.00 317.11 0.00e+00 1.346706e-03 6.296310e-04 6.638305e-05 -6.000000e+00 8.387595e-04 278.36 -2.00 20.00 -2.00 316.45 0.00e+00 1.233 0.000 302.00 328.00 3 7.5777e+00 1.2341e-02 1.7430e-02 -6.0000e+00 4.8371e-02 6.8463e-02 1.3874e-02 1.2372e-02 -6.0000e+00 5.2598e-02 4.2574e-03 8.2698e-03 6.0675e-03 -6.0000e+00 3.1226e-02 -9.5671e-03 4.0388e-03 1.9771e-03 -6.0000e+00 1.3213e-02 5.7878e-05 -3.1339e-04 2.6052e-04 1.9437e-05 -6.0000e+00 8.8000e-04 1.3769e-02 5.5830e-05 12 9 8 11 8 0 62.97 18.16 0.91 0.01377 0.01141 6 6 2 8 0 4000.000 15.00 18.16 18.43 21.69 21.58 21.3 1025.23 -12414 3228 7826 16349 -5482 2447 -5750 10120 -7758 2352 -5090 5050 -6982 2526 13639 -4690 5939 -4705 -3623 -283 7462 -801 9021 -3113 3591 -5099 4564 -598 -1667 -3829 2584 2296 -1321 -751 -4156 -128 -3960 -3662 1845 2620 -2504 363 49 -1397 3036 -1441 -2130 -3729 -85 -1706 3114 -1662 1568 2761 2241 -2227 1063 269 352 729 -3765 1343 -692 1851 1235 2094 -3811 1036 654 394 1616 384 1923 1802 1390 -491 790 -1899 -2437 -2703 -657 -1251 -985 -1746 77 566 1645 -7 1185 689 -68 -1196 -256 -2120 591 -1008 436 1601 852 1334 -60 -1499 -2238 -1473 139 -1899 -456 -168 -4 510 670 453 -138 -953 -1563 -431 -866 -1066 -139 236 425 -223 951 1387 1795 696 -613 1330 1042 -43 153 -284 -541 -272 -269 1742 -713 276 1064 443 116 -1492 -1549 -1775 434 1035 1866 -673 271 -702 1206 -1192 346 -810 727 -1235 465 2562 -1174 1382 -1257 -994 -78 1931 -220 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