File name: Pandora272s1_Lauder_20260224_L2Fit_fout2c2d20241202p1-8.txt File generation date: 20260224T125957.5Z 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_20260224_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: 20260224 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 20260223T193649.4Z 9550.817239 442 1 10.29 2 75.77 89.40 151.28 127.00 0.00 1 0.00 1 0 17 1.601e-01 1.371e-02 6.694e-02 5.700e-03 4.381934e-01 2.936949e-03 5.293997e-03 -6.000000e+00 9.324941e-02 229.95 -2.00 3.69 -2.00 319.21 0.00e+00 3.076801e-03 7.393419e-04 3.744804e-04 -6.000000e+00 4.082255e-03 279.43 -2.00 20.00 -2.00 318.60 0.00e+00 3.981 0.001 302.00 328.00 3 3.6231e+00 8.1687e-03 4.4860e-02 -6.0000e+00 2.3304e-01 4.3084e-02 9.4443e-03 2.4152e-02 -6.0000e+00 2.5212e-01 -5.3376e-02 7.1809e-03 1.2282e-02 -6.0000e+00 1.4951e-01 2.3776e-02 3.7832e-03 4.9366e-03 -6.0000e+00 6.3675e-02 1.9361e-04 6.4339e-04 1.6338e-04 4.7613e-05 -6.0000e+00 4.4490e-03 1.8981e-02 6.7205e-05 12 9 9 12 9 1 24.28 25.29 0.21 0.01898 0.02382 4 3 1 8 0 2056.730 20.01 25.29 19.32 35.00 34.00 1.0 960.00 -10549 -67219 -33900 -1843 900000 -44079 64046 -79620 -51074 -63343 -36360 -42907 -6360 2993 -13236 33545 -31678 15708 -17315 8283 -9185 20622 -14961 -7420 16515 14196 -10809 6100 -5922 -7226 -1126 13936 -7261 24451 -19552 19753 5459 -1377 7769 6563 -28 9898 361 1911 2684 2219 4208 4610 -4382 57 8158 2150 4863 -953 950 979 2725 -2253 -3066 3019 4826 3163 1936 1840 -1264 -1898 2333 -2571 2085 -912 2068 -362 -1718 1853 -382 -526 -315 -679 -1011 -533 -650 -837 -3666 -3539 -1815 -166 -624 204 645 -412 589 -415 -432 -632 -816 -156 -565 1757 219 1339 189 -58 -2103 -1101 433 -627 -202 20 -589 210 81 354 -86 -199 620 297 -708 938 -577 961 388 -124 632 709 1275 1015 -299 -64 -2 -552 653 -71 344 -445 -39 19 -342 449 365 -601 -72 -519 -539 -240 -3064 -1168 -44 900000 -1421 748 -4337 -2328 -3485 -1556 -2122 -262 136 -853 1566 -3099 1030 -1684 654 -883 1467 -1572 -771 1423 1310 -1304 597 -625 -803 -133 1596 -1154 3003 -3554 2382 834 -262 1624 1502 -8 2596 109 583 820 692 1293 1416 -1492 19 2737 839 1985 -443 455 442 1240 -1079 -1450 1452 2350 1554 1069 1120 -821 -1185 1335 -1542 1266 -599 1467 -277 -1341 1341 -263 -354 -193 -404 -640 -385 -499 -727 -3321 -3378 -1820 -176 -655 220 701 -441 623 -409 -398 -570 -785 -167 -646 2225 289 1753 239 -73 -2453 -1258 526 -819 -258 27 -857 309 130 560 -136 -318 920 440 -1045 1326 -881 1538 639 -202 997 1079 1834 1490 -427 -91 -3 -873 1039 -120 602 -816 -71 37 -657 873 722 -1172 -140 -974 -975 SS 20260223T210652.3Z 9550.879772 498 1 55.12 2 60.13 72.33 137.73 102.50 0.00 1 0.00 1 0 17 2.515e-02 1.039e-02 4.042e-03 1.816e-03 2.337635e-01 9.342055e-04 2.909929e-03 -6.000000e+00 1.462605e-02 229.94 -2.00 3.69 -2.00 316.48 0.00e+00 5.890444e-04 1.073638e-04 7.730674e-05 -6.000000e+00 6.304644e-04 279.42 -2.00 20.00 -2.00 315.84 0.00e+00 1.999 0.000 302.00 328.00 3 5.3551e+00 2.4377e-03 2.2888e-02 -6.0000e+00 3.6571e-02 3.6487e-02 2.7156e-03 1.2627e-02 -6.0000e+00 3.9569e-02 -9.4056e-03 1.5861e-03 6.1443e-03 -6.0000e+00 2.3480e-02 4.7290e-03 7.4988e-04 1.7441e-03 -6.0000e+00 9.9893e-03 2.8240e-04 -1.7865e-04 5.2168e-05 1.9826e-05 -6.0000e+00 6.9192e-04 1.9964e-02 -4.2759e-05 12 8 8 10 0 0 99.98 25.31 0.34 0.01996 0.01862 30 3 1 8 0 1837.310 20.00 25.31 22.90 35.00 33.75 0.8 974.30 668 -7879 -207 114 12060 -4736 1298 -11826 -283 -10018 -6761 -6354 -989 1855 -853 2221 -3973 3728 -1719 2163 582 3094 -260 1328 1506 4805 -1260 783 -645 -363 -1287 4073 549 4899 -7014 47 -1180 -2487 1876 1665 -1807 2336 -709 51 -642 1189 -104 1043 -2841 -1184 1505 1052 1090 -100 817 199 1711 -1098 -717 2028 2529 1836 1553 1235 -245 -874 688 -2036 748 486 1387 480 -700 1251 -394 -784 -563 -1550 -1599 -949 -2097 -1305 -2310 -2866 -1198 -253 -83 17 904 -122 827 -79 -440 -656 -181 -675 -252 1526 278 1370 171 -788 -2021 -341 381 -597 157 -135 -543 179 520 457 286 742 255 -260 -480 398 -20 824 37 -321 884 890 1331 502 -493 3 -71 -453 536 -274 184 -342 64 -75 -284 347 396 -206 -218 -571 -869 116 -1464 -40 20 1695 -756 206 -2364 -56 -2079 -1473 -1404 -230 433 -231 640 -1267 1136 -574 717 199 1021 -90 479 564 1802 -504 289 -222 -122 -461 1470 221 1950 -2947 18 -494 -1110 954 996 -1134 1467 -473 34 -431 782 -68 654 -1806 -737 953 714 779 -76 639 158 1368 -903 -576 1573 2002 1448 1330 1133 -229 -763 588 -1724 637 432 1352 464 -692 1259 -379 -682 -474 -1232 -1291 -844 -1967 -1344 -2415 -3150 -1381 -292 -101 22 1146 -151 947 -89 -455 -686 -194 -740 -305 1889 375 1822 218 -947 -2441 -405 458 -772 210 -179 -757 261 757 682 416 1068 339 -341 -616 521 -28 1160 54 -475 1269 1234 1843 666 -629 4 -92 -629 731 -391 266 -509 99 -118 -461 572 666 -343 -350 -892 -1321 SS 20260223T211158.2Z 9550.883313 501 1 54.27 2 59.28 71.26 136.90 101.43 0.00 1 0.00 1 0 17 1.043e-02 7.207e-03 1.452e-03 8.090e-04 2.279599e-01 4.187518e-04 2.885488e-03 -6.000000e+00 6.065106e-03 229.94 -2.00 3.69 -2.00 315.79 0.00e+00 3.738734e-04 4.127754e-05 6.673830e-05 -6.000000e+00 2.612876e-04 279.42 -2.00 20.00 -2.00 315.18 0.00e+00 1.949 0.000 302.00 328.00 3 3.9848e+00 1.0849e-03 2.2352e-02 -6.0000e+00 1.5166e-02 2.6894e-02 1.2044e-03 1.2367e-02 -6.0000e+00 1.6406e-02 -7.0429e-04 6.9414e-04 6.0311e-03 -6.0000e+00 9.7352e-03 -1.9537e-03 3.1803e-04 1.6907e-03 -6.0000e+00 4.1438e-03 1.1802e-03 7.4010e-05 2.3100e-05 2.0843e-05 -6.0000e+00 2.8674e-04 1.8888e-02 6.0474e-05 11 8 0 10 0 0 99.70 25.31 0.35 0.01889 0.01944 94 10 1 8 0 577.230 20.00 25.31 23.00 35.00 33.75 0.8 975.13 -875 -1944 -541 -1578 278 -2542 -991 -3130 87 -3199 -2584 -2554 -614 530 451 1001 -430 1580 675 1433 965 975 739 530 891 1813 -147 -177 -681 213 261 2067 1054 769 -3407 -2114 -2318 -1719 -63 415 -917 333 -605 325 -421 245 -386 -321 -1598 -705 868 797 1002 891 941 642 1094 82 96 641 1044 1180 1351 1819 658 -183 -29 -1190 286 507 520 484 315 685 61 -290 -865 -1452 -980 -1033 -1124 -1084 -1830 -2654 -1266 -692 -308 202 662 387 374 260 -280 -499 -91 -42 248 1073 690 384 98 -875 -1668 -533 -415 -638 -393 -399 -303 244 637 679 381 453 -93 -112 -200 94 58 581 67 213 502 472 745 640 -12 401 369 136 257 -116 -329 -288 21 95 -150 271 176 -138 -233 -522 -837 -196 -479 -134 -369 62 -555 -225 -736 22 -879 -696 -699 -183 163 157 379 -172 593 265 576 397 397 308 233 406 848 -71 -80 -285 86 111 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