File name: Pandora272s1_Lauder_20260327_L2Fit_fout2c2d20241202p1-8.txt File generation date: 20260327T125241.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Richard Querel Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 272 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora272_OF_v3d20240829.txt Instrument calibration file used: Pandora272s1_CF_v2d20241202.txt Level 1 file used: Pandora272s1_Lauder_20260327_L1_smca1c2d20241202p1-8.txt Full location name: Lauder Atmospheric Research Station Short location name: Lauder Country of location: New Zealand Location latitude [deg]: -45.0380 Location longitude [deg]: 169.6840 Location altitude [m]: 370 Local noon date: 20260327 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: OoB based on session 1 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0435 305.1840 305.3244 305.4648 305.6052 305.7456 305.8860 306.0263 306.1667 306.3070 306.4473 306.5877 306.7280 306.8683 307.0086 307.1488 307.2891 307.4293 307.5696 307.7098 307.8500 307.9902 308.1304 308.2706 308.4108 308.5510 308.6911 308.8313 308.9714 309.1115 309.2516 309.3917 309.5318 309.6719 309.8119 309.9520 310.0920 310.2321 310.3721 310.5121 310.6521 310.7921 310.9320 311.0720 311.2120 311.3519 311.4918 311.6317 311.7717 311.9115 312.0514 312.1913 312.3312 312.4710 312.6109 312.7507 312.8905 313.0303 313.1701 313.3099 313.4496 313.5894 313.7292 313.8689 314.0086 314.1483 314.2880 314.4277 314.5674 314.7071 314.8467 314.9864 315.1260 315.2656 315.4052 315.5448 315.6844 315.8240 315.9636 316.1031 316.2427 316.3822 316.5217 316.6612 316.8007 316.9402 317.0797 317.2192 317.3586 317.4981 317.6375 317.7769 317.9163 318.0557 318.1951 318.3345 318.4738 318.6132 318.7525 318.8918 319.0312 319.1705 319.3097 319.4490 319.5883 319.7276 319.8668 320.0060 320.1453 320.2845 320.4237 320.5629 320.7020 320.8412 320.9804 321.1195 321.2586 321.3977 321.5368 321.6759 321.8150 321.9541 322.0932 322.2322 322.3713 322.5103 322.6493 322.7883 322.9273 323.0663 323.2052 323.3442 323.4831 323.6221 323.7610 323.8999 324.0388 324.1777 324.3166 324.4554 324.5943 324.7331 324.8719 --------------------------------------------------------------------------------------- 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 20260326T203303.0Z 9581.856285 356 1 54.07 2 73.43 68.82 159.52 153.57 0.00 1 0.00 1 0 17 2.039e-01 1.634e-02 5.075e-02 2.977e-03 3.611287e-01 1.506706e-03 4.422391e-03 -6.000000e+00 1.172711e-01 226.92 -2.00 3.69 -2.00 318.58 0.00e+00 1.833103e-03 3.088871e-04 1.324022e-04 -6.000000e+00 5.089697e-03 278.47 -2.00 20.00 -2.00 317.95 0.00e+00 3.451 0.000 302.00 328.00 3 4.6050e+00 4.0823e-03 3.8082e-02 -6.0000e+00 2.9123e-01 7.8912e-02 4.6472e-03 1.9588e-02 -6.0000e+00 3.1581e-01 -5.3652e-02 3.1636e-03 9.7028e-03 -6.0000e+00 1.8775e-01 2.5762e-02 1.6528e-03 3.3959e-03 -6.0000e+00 8.0346e-02 1.2857e-04 5.8906e-04 8.6492e-05 3.4420e-05 -6.0000e+00 5.6035e-03 2.0298e-02 7.0085e-05 12 8 8 10 0 0 99.59 25.35 0.15 0.02030 0.02472 17 2 1 8 0 3180.330 19.99 25.35 17.29 35.25 33.75 1.0 951.83 4593 -2876 -12002 -2083 211369 -20227 -4028 -51602 -10215 -46970 -51395 -25489 9712 -2812 -3739 4947 -21563 4794 -15545 14789 -4937 6999 -4770 614 7870 13689 -1860 4459 6531 695 -5144 9009 526 18999 -13860 12675 658 -4667 4097 8741 -2162 11904 806 2316 2952 3367 2485 3083 -6785 2686 4514 3272 2754 -1558 1393 597 1281 -2861 -5128 5849 6217 2968 2053 1879 -3329 -3043 4055 -3786 2232 205 1197 870 -1697 2084 -1177 -1779 378 -2103 -1724 -2056 -2495 231 -3006 -3594 -2293 -39 -468 -606 1581 -1039 1199 -804 124 -805 21 -1474 -603 2027 586 2594 -199 -1108 -2033 469 720 -408 190 104 -786 -107 610 -138 28 431 1367 -329 -864 659 -455 639 -147 -131 709 454 1809 536 -416 61 11 -692 1419 -232 208 -409 -24 -104 -399 425 -97 -11 -111 -116 -959 195 -146 -693 -103 1105 -1039 -187 -4270 -620 -4364 -5014 -2028 632 -245 -385 529 -3212 580 -2428 1773 -734 916 -723 94 1170 1999 -321 686 927 106 -913 1530 107 3381 -3239 2223 142 -1230 1186 2598 -794 4000 315 907 1152 1317 975 1191 -2888 1059 1866 1484 1338 -843 764 338 735 -1710 -3070 3106 3382 1794 1376 1258 -2401 -2064 2639 -2626 1532 149 955 733 -1474 1680 -913 -1252 258 -1405 -1198 -1488 -2067 208 -2810 -3551 -2388 -43 -542 -729 1885 -1237 1297 -816 125 -791 21 -1575 -718 2457 781 3397 -254 -1324 -2435 545 902 -512 247 144 -1158 -158 955 -227 46 657 2054 -470 -1216 944 -701 969 -231 -204 1069 709 2646 759 -568 82 16 -1083 2169 -379 348 -712 -41 -190 -754 814 -189 -21 -202 -205 -1755 SS 20260326T203841.7Z 9581.860205 359 1 54.06 2 72.51 67.70 159.07 150.43 0.00 1 0.00 1 0 17 6.129e-02 9.961e-03 9.567e-03 1.809e-03 3.441793e-01 9.157516e-04 4.266819e-03 -6.000000e+00 3.524923e-02 226.92 -2.00 3.69 -2.00 318.15 0.00e+00 1.247124e-03 1.657048e-04 1.372768e-04 -6.000000e+00 1.529892e-03 278.47 -2.00 20.00 -2.00 317.51 0.00e+00 3.280 0.000 302.00 328.00 3 3.9835e+00 2.4488e-03 3.6229e-02 -6.0000e+00 8.7538e-02 4.2037e-02 2.7670e-03 1.8610e-02 -6.0000e+00 9.4928e-02 -2.4383e-02 1.8054e-03 9.1841e-03 -6.0000e+00 5.6435e-02 8.7823e-03 9.3575e-04 2.8690e-03 -6.0000e+00 2.4150e-02 2.9120e-04 2.8987e-04 5.2266e-05 2.9569e-05 -6.0000e+00 1.6844e-03 2.0560e-02 7.3027e-05 12 8 8 10 0 0 99.97 25.35 0.24 0.02056 0.02274 51 5 1 8 0 1059.850 20.00 25.35 17.51 35.25 33.75 1.0 952.68 -8748 -4852 -14015 -6361 39941 -9000 -5579 -29427 -3471 -25337 -28054 -10074 1362 1064 587 3836 -8538 1688 -5186 6861 -3954 408 -3929 3063 3355 7796 -848 -1433 706 -1696 -3569 5940 2212 8002 -9093 1117 -1938 -2608 196 2644 -1714 4693 -1350 457 884 2133 1570 886 -3466 -908 3142 1765 2044 75 1573 396 2027 -1295 -1558 2299 283 1989 2155 1966 -1153 -1082 1577 -2069 678 319 559 998 -449 1497 -389 -800 -866 -1906 -1158 -746 -1297 -857 -2367 -2905 -1553 -197 -513 -65 912 148 921 -137 -30 -530 -428 -236 -175 1521 566 1042 170 -784 -2206 -142 16 -359 -270 -301 -561 -49 479 258 127 328 294 -40 -583 13 66 575 -2 269 791 413 978 436 37 299 -9 -220 525 208 -381 -324 71 124 -375 519 -22 64 -211 -501 -696 -531 -315 -1036 -412 1459 -521 -333 -2477 -251 -2428 -2777 -876 122 112 73 520 -1398 264 -913 1115 -730 72 -744 576 661 1534 -168 -298 135 -335 -782 1300 503 1803 -2302 250 -488 -765 67 1047 -721 1951 -620 210 405 971 714 401 -1631 -423 1498 924 1137 45 979 236 1213 -802 -948 1444 172 1277 1515 1504 -863 -822 1098 -1469 491 243 472 884 -406 1284 -318 -637 -625 -1325 -830 -602 -1110 -817 -2323 -3012 -1696 -214 -590 -77 1088 173 1061 -147 -30 -543 -428 -261 -204 1958 750 1379 215 -988 -2606 -163 20 -478 -354 -416 -823 -73 756 401 195 503 418 -56 -809 19 94 874 -3 420 1201 608 1437 616 50 398 -13 -321 811 338 -607 -532 123 217 -680 955 -42 118 -374 -903 -1215 SS 20260326T204400.6Z 9581.863896 362 1 41.47 2 71.64 66.64 158.60 147.58 0.00 1 0.00 1 0 17 3.034e-02 8.585e-03 6.324e-03 1.596e-03 3.314847e-01 8.082054e-04 4.139249e-03 -6.000000e+00 1.745305e-02 226.92 -2.00 3.69 -2.00 317.63 0.00e+00 3.553073e-04 1.258638e-04 1.676702e-04 -6.000000e+00 7.572466e-04 278.47 -2.00 20.00 -2.00 316.98 0.00e+00 3.135 0.000 302.00 328.00 3 3.6880e+00 2.1396e-03 3.4686e-02 -6.0000e+00 4.3344e-02 4.9948e-02 2.4058e-03 1.7855e-02 -6.0000e+00 4.6998e-02 -1.7052e-02 1.5073e-03 8.7940e-03 -6.0000e+00 2.7940e-02 4.2639e-03 7.6820e-04 2.5244e-03 -6.0000e+00 1.1960e-02 4.5313e-04 3.6639e-04 4.5781e-05 2.7673e-05 -6.0000e+00 8.3370e-04 1.9720e-02 1.1962e-04 12 9 1 12 1 1 99.88 25.36 0.27 0.01972 0.02247 29 4 1 8 0 1382.170 20.00 25.36 17.70 35.25 33.75 1.0 953.50 -6890 -6067 -7215 -1212 10257 -8914 -5015 -3825 -3776 -13084 -18956 -6556 -1392 -1341 -952 804 -6330 1476 -2981 4748 -2236 897 -916 1541 1687 4374 -1468 67 176 -684 -1556 3225 1685 4316 -6558 335 -3292 -1826 709 1903 -1315 -662 -280 1003 746 1476 962 491 -2458 128 1877 1705 1765 167 910 587 1088 -484 -379 1796 2227 1702 1568 2055 -515 -1060 863 -1446 238 574 922 527 -243 902 -28 -552 -587 -2260 -1403 -1720 -1614 -1110 -2082 -2581 -1200 -555 -382 131 930 290 553 -325 21 -227 -249 -217 -200 1442 438 991 -99 -907 -1834 -477 -73 -1003 -577 -157 -370 141 609 471 364 499 263 -88 -442 158 -210 533 130 115 533 305 899 690 -114 205 283 578 305 -36 -102 -445 -86 90 -258 553 87 -117 -296 -468 -855 -559 -541 -675 -101 682 -696 -403 -339 -374 -1517 -2342 -748 -173 -194 -145 135 -1213 275 -611 937 -483 187 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