File name: Pandora206s1_BuffaloNY_20231015_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20231017T065106.2Z 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 v1.8.49 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20231015_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: 20231015 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 20231015T151311.4Z 8688.634160 138 1 24.01 2 57.12 147.75 65.85 140.39 0.00 1 0.00 1 0 17 1.484e-01 2.643e-02 1.163e-01 1.982e-02 2.410180e-01 9.736005e-03 3.081757e-03 -6.000000e+00 8.245666e-02 225.54 -2.00 3.55 -2.00 317.89 0.00e+00 1.527266e-03 1.660046e-03 7.693243e-04 -6.000000e+00 3.654459e-03 281.68 -2.00 20.00 -2.00 317.18 0.00e+00 1.836 0.000 302.00 328.00 3 7.9091e+00 2.5952e-02 2.2150e-02 -6.0000e+00 2.0400e-01 2.8893e-02 2.9422e-02 1.3790e-02 -6.0000e+00 2.2215e-01 8.7333e-02 1.8862e-02 6.2149e-03 -6.0000e+00 1.3246e-01 -4.8716e-02 9.7434e-03 2.4103e-03 -6.0000e+00 5.6639e-02 2.3326e-05 -7.4086e-04 5.5637e-04 2.3440e-05 -6.0000e+00 3.7790e-03 4.2698e-03 -1.1109e-04 12 8 8 10 0 0 -12.09 18.06 1.64 0.00427 -0.00130 6 6 2 8 0 4000.000 15.00 18.06 16.86 21.58 21.48 18.9 939.98 1544 78399 19180 15260 -6586 107880 -8694 32714 -7716 30478 64204 -4304 -18855 26509 -8756 1629 30109 -9072 7142 -8700 18628 -7995 18086 -1550 7311 6810 12672 -56 -2976 20816 5559 1024 764 13513 -9513 -4129 2479 3588 3128 -2275 -7888 -2580 7855 -5664 2592 -2749 -1549 -14715 3581 -7925 1671 1440 1286 -413 1702 -3585 -5738 6205 -2967 -937 -4630 6424 -468 5963 -801 5589 -3490 -1650 -1629 -1365 2160 760 587 893 5521 916 2309 -2160 -11686 -4643 818 941 -2006 -400 -843 4679 3117 280 644 4010 -849 3155 -2298 380 -874 -2669 978 7483 975 484 732 -422 -1064 -3132 3410 -2689 93 -1959 -291 -705 -345 -602 -2350 -773 -1448 1400 -796 793 -2185 1737 -2069 -2796 1093 23 2185 2599 -2357 2100 1451 -1668 3089 230 1303 -1984 242 -655 1866 140 173 230 147 -1150 -242 116 3132 1399 1104 -517 2732 -699 2002 -770 2298 3509 -440 -2528 2699 -1414 266 3867 -1793 1256 -1866 3124 -1725 3056 -338 1527 1490 2743 -13 -656 3554 1182 245 200 3274 -2679 -1056 652 1075 1133 -997 -4018 -1298 3693 -3094 1300 -1462 -801 -8441 1730 -4269 863 802 755 -252 1051 -2365 -3950 3906 -2001 -615 -3246 4338 -356 4577 -659 4070 -2568 -1150 -1190 -1137 1913 691 553 808 4450 691 1546 -1468 -8749 -3665 686 873 -2046 -416 -946 5345 3683 352 812 4711 -995 3234 -2261 347 -852 -2925 1146 9156 1311 661 934 -502 -1186 -3673 4115 -3630 127 -2871 -424 -1097 -565 -999 -3811 -1183 -2035 1780 -1030 1052 -3211 2633 -3334 -4470 1644 33 2930 3426 -3081 2619 1954 -2388 4436 349 1981 -3221 410 -1178 3346 262 327 420 259 -1990 -405 SS 20231015T152523.2Z 8688.642630 143 1 2.03 2 55.98 151.10 64.54 143.25 0.00 1 0.00 1 0 25 1.106e-02 6.336e-03 8.677e-03 3.711e-03 2.389160e-01 1.829999e-03 2.928692e-03 -6.000000e+00 6.146480e-03 225.54 -2.00 3.55 -2.00 316.61 0.00e+00 2.928511e-04 2.228404e-04 4.172693e-05 -6.000000e+00 2.724028e-04 281.67 -2.00 20.00 -2.00 315.92 0.00e+00 1.782 0.000 302.00 328.00 3 3.2861e+00 4.7619e-03 2.1305e-02 -6.0000e+00 1.5206e-02 1.3919e-02 5.3510e-03 1.2277e-02 -6.0000e+00 1.6560e-02 -6.1781e-03 3.1334e-03 6.0722e-03 -6.0000e+00 9.8744e-03 1.3126e-03 1.5024e-03 1.7299e-03 -6.0000e+00 4.2209e-03 2.6278e-03 -1.4918e-04 1.0138e-04 1.9134e-05 -6.0000e+00 2.8168e-04 1.0017e-02 7.4922e-05 12 1 1 12 1 1 46.53 18.06 0.33 0.01002 0.00890 4 67 2 8 0 404.830 15.00 18.06 17.22 21.58 21.48 18.9 942.48 -2532 1073 -787 -427 -5642 -2811 -3764 -1499 -1699 -704 -1878 -1474 226 -1597 1796 -1939 1215 371 823 853 754 1398 169 762 395 653 1144 -704 -192 959 966 570 1025 902 -2656 1964 -3115 -1233 1030 85 -334 -1204 -217 -1054 -1532 -834 636 -736 105 -962 722 -39 1314 800 403 1173 743 663 311 697 146 1368 1337 1574 76 327 -538 -479 41 189 1049 -131 351 45 993 36 -475 -1037 -676 -1290 -742 -759 -2124 -1842 -869 -103 -347 117 -5 585 -65 1140 92 330 29 -380 393 882 235 -118 200 -1049 -495 112 -401 -984 -592 -660 -338 209 534 9 54 8 -298 -42 211 374 72 358 -476 83 216 294 1015 577 149 909 603 379 211 53 -287 27 462 139 -122 -52 -69 -203 -546 -495 -419 -411 185 -142 -72 -872 -398 -569 -247 -314 -137 -362 -283 48 -391 450 -559 351 112 256 274 248 448 56 265 144 247 435 -255 -63 304 325 205 399 368 -1031 698 -1277 -572 524 48 -209 -790 -145 -719 -1042 -564 415 -472 65 -598 466 -27 951 579 302 885 575 512 235 520 113 1119 1188 1413 69 286 -438 -377 34 168 1017 -134 358 45 904 31 -374 -820 -552 -1130 -685 -776 -2226 -2001 -1005 -121 -430 149 -6 719 -74 1230 96 330 31 -423 459 1140 310 -153 253 -1240 -573 134 -502 -1303 -777 -909 -485 304 816 13 80 11 -395 -55 272 504 99 506 -694 119 316 411 1397 762 187 1131 808 516 304 78 -431 41 725 221 -199 -87 -117 -332 -863 -790 -651 SS 20231015T154524.4Z 8688.656533 154 1 14.66 2 54.38 156.81 62.59 148.11 0.00 1 0.00 1 0 17 9.138e-03 5.620e-03 1.584e-03 7.017e-04 2.274939e-01 3.447330e-04 2.789099e-03 -6.000000e+00 5.078495e-03 225.54 -2.00 3.55 -2.00 316.55 0.00e+00 3.570135e-04 4.123605e-05 3.989965e-05 -6.000000e+00 2.250547e-04 281.67 -2.00 20.00 -2.00 315.86 0.00e+00 1.712 0.000 302.00 328.00 3 2.2145e+00 8.9655e-04 2.0406e-02 -6.0000e+00 1.2564e-02 -4.5120e-03 1.0080e-03 1.1691e-02 -6.0000e+00 1.3682e-02 -3.4444e-03 5.8889e-04 5.7797e-03 -6.0000e+00 8.1581e-03 -2.5965e-04 2.8082e-04 1.6542e-03 -6.0000e+00 3.4884e-03 8.4364e-03 2.9871e-05 1.9112e-05 1.8261e-05 -6.0000e+00 2.3272e-04 5.7376e-03 -4.2038e-05 12 1 1 12 1 1 99.10 18.06 0.29 0.00574 0.00596 125 124 1 8 0 114.450 15.00 18.06 18.04 21.58 21.48 18.9 946.57 -2444 -1235 -730 -2269 -4155 -2451 -1876 -474 -365 -419 -2049 -2306 -1271 -842 328 -497 247 428 946 981 1208 425 935 763 332 717 256 -211 -901 626 1204 1209 1751 195 -1901 -1834 -1503 -1121 -282 -35 -749 -672 -482 -631 -242 -262 -331 -405 -717 -2 829 663 1013 1095 674 1030 970 664 588 496 912 1048 1318 1616 191 -97 -377 -657 200 325 209 200 31 297 183 -121 -102 -703 -148 -699 -1036 -1027 -1984 -1690 -1163 -784 -424 -161 230 97 314 349 150 440 510 194 404 670 237 -194 -186 -643 -592 77 -514 -793 -582 -579 -326 148 326 158 126 50 1 204 186 435 231 137 -246 47 290 261 656 480 623 1113 585 335 286 133 -172 50 -21 -140 -85 84 -152 -256 -231 -508 -593 -424 -232 -140 -416 -670 -367 -295 -82 -70 -86 -417 -470 -286 -195 85 -144 74 131 299 320 402 140 310 269 123 275 99 -77 -302 201 407 435 679 80 -731 -677 -607 -519 -143 -21 -492 -458 -312 -413 -156 -183 -227 -269 -466 -1 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