File name: Pandora206s1_BuffaloNY_20241223_L2Fit_fout2c6d20240814p1-8.txt File generation date: 20241224T051720.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 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_v6d20240814.txt Level 1 file used: Pandora206s1_BuffaloNY_20241223_L1_smca1c6d20240814p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: United States Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20241223 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]: 305.0348 305.1758 305.3167 305.4577 305.5987 305.7396 305.8805 306.0215 306.1624 306.3033 306.4442 306.5850 306.7259 306.8668 307.0076 307.1484 307.2893 307.4301 307.5709 307.7117 307.8524 307.9932 308.1340 308.2747 308.4154 308.5561 308.6968 308.8375 308.9782 309.1189 309.2596 309.4002 309.5408 309.6815 309.8221 309.9627 310.1033 310.2438 310.3844 310.5250 310.6655 310.8060 310.9466 311.0871 311.2276 311.3681 311.5085 311.6490 311.7894 311.9299 312.0703 312.2107 312.3511 312.4915 312.6319 312.7723 312.9126 313.0530 313.1933 313.3336 313.4740 313.6143 313.7545 313.8948 314.0351 314.1753 314.3156 314.4558 314.5960 314.7362 314.8764 315.0166 315.1568 315.2970 315.4371 315.5772 315.7174 315.8575 315.9976 316.1377 316.2777 316.4178 316.5579 316.6979 316.8379 316.9780 317.1180 317.2580 317.3980 317.5379 317.6779 317.8178 317.9578 318.0977 318.2376 318.3775 318.5174 318.6573 318.7972 318.9370 319.0769 319.2167 319.3565 319.4963 319.6361 319.7759 319.9157 320.0554 320.1952 320.3349 320.4747 320.6144 320.7541 320.8938 321.0335 321.1731 321.3128 321.4524 321.5921 321.7317 321.8713 322.0109 322.1505 322.2900 322.4296 322.5692 322.7087 322.8482 322.9877 323.1272 323.2667 323.4062 323.5457 323.6851 323.8246 323.9640 324.1034 324.2428 324.3822 324.5216 324.6610 324.8003 324.9397 --------------------------------------------------------------------------------------- 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 20241223T142135.2Z 9123.598325 294 1 46.29 2 77.42 139.91 60.77 228.78 0.00 1 0.00 1 0 17 2.352e-01 6.644e-03 2.352e-01 4.948e-03 5.993516e-01 2.546846e-03 6.794544e-03 -6.000000e+00 1.303751e-01 222.65 -2.00 3.55 -2.00 320.85 0.00e+00 3.347204e-03 1.044273e-03 6.781197e-04 -6.000000e+00 6.013974e-03 273.79 -2.00 20.00 -2.00 320.36 0.00e+00 4.466 0.002 302.00 328.00 3 3.2369e+00 7.8092e-03 5.3577e-02 -6.0000e+00 3.2116e-01 4.6582e-02 1.0489e-02 3.2494e-02 -6.0000e+00 3.5110e-01 -4.2238e-02 1.1366e-02 1.7115e-02 -6.0000e+00 2.0803e-01 5.1129e-03 5.6607e-03 7.0605e-03 -6.0000e+00 8.9559e-02 1.3928e-04 -5.3845e-04 1.3772e-04 6.2728e-05 -6.0000e+00 6.1206e-03 7.9153e-03 0.0000e+00 11 8 0 10 0 0 99.75 17.44 0.49 0.00792 0.00387 36 11 1 8 0 1285.570 15.00 17.44 2.06 21.06 20.87 22.6 896.13 -84906 900000 -139949 67363 900000 -90890 900000 -51549 -83557 -4317 -17673 900000 -16440 119076 -27557 24459 14485 21771 7522 -9253 27883 -23430 -15993 -6527 -29827 -7961 -15886 -48236 -24873 -4264 4944 10160 -7770 2878 7347 -10521 -7052 -7989 2992 11168 -3179 -1802 5270 -722 4896 -2124 -7303 -11552 2443 42 43 3187 75 3745 2366 -53 -1151 227 12 4393 3003 1905 2296 3336 3367 -1012 -920 -676 2241 -608 2858 -978 1748 1634 362 218 -1723 -1252 -3884 -1379 -1167 -625 -3081 -934 -188 289 423 323 1051 1294 -14 1003 1185 -1355 -366 -621 132 520 111 -150 459 -690 -997 -465 -536 -765 -608 -4 -740 142 -43 14 292 -77 159 -132 -163 529 327 25 -40 -73 551 -251 -95 -108 128 620 628 -130 383 454 -226 69 -314 -351 -290 518 -39 139 -234 -249 56 -521 900000 -1963 325 900000 -677 900000 -316 -806 -21 -101 900000 -130 574 -399 257 190 296 129 -199 428 -596 -393 -160 -994 -227 -508 -2072 -818 -121 154 356 -381 140 325 -540 -386 -518 214 896 -334 -201 580 -87 564 -270 -999 -1696 326 6 7 556 15 775 528 -12 -285 55 3 978 698 492 671 1097 1172 -354 -315 -236 825 -268 1353 -504 870 771 158 85 -634 -458 -1614 -665 -655 -400 -2034 -635 -135 222 342 269 873 1033 -11 754 847 -1006 -275 -540 131 592 139 -187 533 -734 -958 -446 -561 -844 -705 -5 -999 212 -66 23 468 -119 231 -197 -244 822 500 41 -64 -112 884 -391 -142 -155 176 873 1000 -215 691 870 -455 147 -716 -784 -659 1191 -91 307 -527 -530 114 SS 20241223T142751.6Z 9123.602680 297 1 45.98 2 76.69 141.18 61.65 230.22 0.00 1 0.00 1 0 17 3.911e-01 1.143e-02 2.721e-01 7.420e-03 5.748158e-01 3.867242e-03 6.670377e-03 -6.000000e+00 2.205059e-01 222.65 -2.00 3.55 -2.00 320.61 0.00e+00 7.458303e-04 1.484160e-03 8.578216e-04 -6.000000e+00 1.068532e-02 273.79 -2.00 20.00 -2.00 320.12 0.00e+00 4.238 0.001 302.00 328.00 3 4.3591e+00 1.1675e-02 5.0997e-02 -6.0000e+00 5.4486e-01 5.3428e-02 1.5212e-02 3.0795e-02 -6.0000e+00 5.9720e-01 -2.3702e-02 1.5973e-02 1.5886e-02 -6.0000e+00 3.5121e-01 1.7025e-03 8.0665e-03 4.9994e-03 -6.0000e+00 1.5186e-01 5.6638e-05 -9.7723e-04 2.1083e-04 5.4351e-05 -6.0000e+00 1.0376e-02 7.4449e-03 0.0000e+00 12 8 8 10 0 0 88.70 17.45 0.43 0.00744 0.00010 12 4 1 8 0 3831.000 15.00 17.45 2.29 21.06 20.87 22.6 898.08 -178396 900000 900000 900000 24531 900000 900000 24216 900000 113006 900000 45177 102524 -1231 65536 44101 900000 30489 59996 -11314 331593 -17060 86794 2349 -1419 9719 3528 60293 -28230 32811 4149 10986 -15327 1600 5759 18990 -14905 14422 20566 402 11758 -4792 15120 -7757 4250 -9709 -16717 -12779 13208 3897 4859 -24 493 8686 6315 -966 565 -3025 -485 -5276 23 1240 -1969 2999 -588 485 -3773 -419 1007 2654 3524 -1302 3508 2131 1750 -1633 881 -3082 -6446 -2124 -963 3600 -3961 972 -1240 1424 838 -562 -389 1365 -460 1743 1103 -532 -1834 -671 559 823 -288 336 298 -1027 365 -1002 503 -1677 -535 275 -688 -409 1198 735 -723 217 81 -487 -357 573 -109 389 -440 -731 433 282 -1146 685 749 583 1254 -857 1662 -28 -432 -595 -767 -227 83 25 806 319 -88 -462 -216 -3593 900000 900000 900000 177 900000 900000 175 900000 817 900000 326 741 -14 505 510 900000 483 795 -314 2396 -517 1003 68 -46 304 122 1176 -1230 838 161 466 -982 95 314 876 -1067 904 1496 42 1261 -650 1775 -1175 574 -1539 -2884 -2164 1789 609 833 -5 108 1910 1516 -259 155 -861 -130 -1453 6 357 -662 1085 -226 182 -1443 -158 404 1178 1729 -704 1799 1051 795 -706 341 -1229 -2913 -1054 -550 2244 -2841 697 -974 1167 725 -509 -353 1174 -373 1322 798 -394 -1474 -613 562 946 -356 410 351 -1112 362 -1009 528 -1897 -628 342 -909 -582 1853 1205 -1165 340 119 -700 -514 851 -169 629 -716 -1148 669 421 -1652 961 1003 802 1873 -1419 2926 -53 -836 -1179 -1632 -493 183 57 1811 689 -184 -946 -424 SS 20241223T144237.4Z 9123.612933 305 1 45.98 2 75.05 144.24 63.77 233.50 0.00 1 0.00 1 0 25 1.148e-01 5.261e-03 8.560e-02 3.056e-03 5.172037e-01 1.522865e-03 5.994210e-03 -6.000000e+00 6.312652e-02 222.65 -2.00 3.55 -2.00 320.25 0.00e+00 1.033819e-03 5.204396e-04 3.974563e-04 -6.000000e+00 2.736440e-03 273.79 -2.00 20.00 -2.00 319.75 0.00e+00 3.803 0.001 302.00 328.00 3 3.2113e+00 4.4173e-03 4.5489e-02 -6.0000e+00 1.5559e-01 1.5377e-02 5.4715e-03 2.6861e-02 -6.0000e+00 1.6996e-01 -2.2362e-02 5.2473e-03 1.3850e-02 -6.0000e+00 1.0110e-01 -7.7710e-04 2.7209e-03 4.4229e-03 -6.0000e+00 4.3234e-02 2.9350e-04 -3.8109e-04 8.4296e-05 4.4835e-05 -6.0000e+00 2.9209e-03 7.7996e-03 0.0000e+00 10 0 0 10 0 0 91.72 17.45 0.36 0.00780 0.00494 45 14 1 8 0 1021.540 15.01 17.45 2.92 21.17 20.87 22.8 902.67 -74139 6746 75 -26145 -22989 -26203 -47600 -51771 -45604 -32040 -21753 -8070 -26823 11058 -7565 135 -10541 -3493 -4025 -10239 7132 -11095 -3099 -1508 -9402 -6412 1126 -7803 -12544 -2921 55 912 -1647 -4232 -3330 1865 -8273 -1749 2922 -884 -1062 -491 58 -16 1610 -1279 -1782 -2861 280 -409 1382 1295 3756 1339 2186 1694 837 863 -289 -760 1045 807 1975 2273 473 1362 -1585 408 640 798 847 587 672 1051 -547 -342 -589 -837 -1646 -1063 -465 -536 -2014 -1404 -1059 -467 -43 -202 692 664 985 914 571 129 411 -116 471 887 143 13 -227 -614 -968 -283 -1008 -813 -734 -628 -579 93 398 322 311 101 -82 185 -311 421 25 -133 -434 -173 441 74 -47 776 339 871 304 228 273 109 -242 35 -177 -218 13 25 28 -126 -127 -90 -95 -1060 50 1 -288 -219 -250 -610 -787 -747 -506 -318 -111 -544 191 -194 4 -368 -124 -155 -442 268 -496 -133 -70 -510 -359 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