File name: Pandora272s1_Lauder_20260116_L2Fit_fout2c6d20241202p1-8.txt File generation date: 20260704T065520.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 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_v6d20241202.txt Level 1 file used: Pandora272s1_Lauder_20260116_L1_smca1c6d20241202p1-8.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: 20260116 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: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0455 305.1861 305.3267 305.4672 305.6077 305.7483 305.8888 306.0293 306.1697 306.3102 306.4507 306.5911 306.7315 306.8720 307.0124 307.1528 307.2931 307.4335 307.5739 307.7142 307.8545 307.9949 308.1352 308.2755 308.4158 308.5560 308.6963 308.8365 308.9768 309.1170 309.2572 309.3974 309.5376 309.6778 309.8179 309.9581 310.0982 310.2383 310.3784 310.5185 310.6586 310.7987 310.9388 311.0788 311.2189 311.3589 311.4989 311.6389 311.7789 311.9189 312.0589 312.1988 312.3388 312.4787 312.6186 312.7585 312.8984 313.0383 313.1782 313.3180 313.4579 313.5977 313.7375 313.8773 314.0171 314.1569 314.2967 314.4364 314.5762 314.7159 314.8556 314.9954 315.1351 315.2747 315.4144 315.5541 315.6937 315.8334 315.9730 316.1126 316.2522 316.3918 316.5314 316.6710 316.8105 316.9501 317.0896 317.2291 317.3686 317.5081 317.6476 317.7871 317.9265 318.0660 318.2054 318.3448 318.4842 318.6236 318.7630 318.9024 319.0417 319.1811 319.3204 319.4598 319.5991 319.7384 319.8777 320.0169 320.1562 320.2955 320.4347 320.5739 320.7131 320.8523 320.9915 321.1307 321.2699 321.4090 321.5482 321.6873 321.8264 321.9655 322.1046 322.2437 322.3828 322.5219 322.6609 322.7999 322.9390 323.0780 323.2170 323.3560 323.4949 323.6339 323.7729 323.9118 324.0507 324.1896 324.3285 324.4674 324.6063 324.7452 324.8840 --------------------------------------------------------------------------------------- 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 20260115T233036.7Z 9511.979591 703 1 52.76 2 29.19 41.06 20.78 320.12 0.00 1 0.00 1 0 17 1.197e-02 9.055e-03 1.863e-03 1.376e-03 1.486668e-01 7.255040e-04 1.879061e-03 -6.000000e+00 7.021951e-03 232.17 -2.00 3.69 -2.00 314.52 0.00e+00 9.690225e-05 5.511832e-05 3.054988e-05 -6.000000e+00 2.992969e-04 278.93 -2.00 20.00 -2.00 314.02 0.00e+00 1.145 0.000 302.00 328.00 3 6.1161e+00 1.8701e-03 1.3661e-02 -6.0000e+00 1.7658e-02 3.0239e-02 2.0602e-03 8.0981e-03 -6.0000e+00 1.9070e-02 -8.1903e-03 1.1788e-03 3.9323e-03 -6.0000e+00 1.1292e-02 1.7447e-03 5.1192e-04 1.0836e-03 -6.0000e+00 4.7813e-03 3.4735e-04 2.9494e-04 3.8973e-05 1.4772e-05 -6.0000e+00 3.2926e-04 3.4871e-03 0.0000e+00 11 9 0 11 8 0 99.04 25.43 0.23 0.00349 0.00570 15 2 1 8 0 3516.920 20.00 25.43 18.85 35.25 33.75 1.0 959.21 2963 704 1055 -482 2720 -2453 -1429 -3367 1140 -2726 -2912 -2421 219 -714 -180 924 -2307 676 -1347 1327 -79 1527 682 1332 604 2071 -314 1806 862 -464 -535 1022 448 1072 -4487 -228 -2139 -2679 -95 413 -674 238 -673 489 -30 388 -187 80 -2114 26 1235 131 1002 960 517 392 763 -26 -673 1315 1598 1675 1197 1676 231 -725 861 -2098 377 437 698 782 79 961 126 -332 -525 -1723 -1689 -918 -1807 -537 -1882 -2997 -1664 -109 122 86 732 60 300 -401 -130 -253 -190 8 258 1151 466 1519 368 -1099 -1900 -413 118 -750 -591 295 -280 1 614 394 292 936 373 -383 -751 -64 -312 722 252 109 540 82 965 545 -516 88 438 312 570 -152 -110 -597 4 122 -138 410 475 24 -224 -543 -1194 1111 289 436 -188 897 -875 -482 -1267 451 -1177 -1228 -1004 95 -345 -88 482 -1269 365 -761 748 -46 859 390 789 372 1201 -186 1060 465 -242 -285 557 259 631 -2606 -122 -1254 -1669 -68 321 -543 197 -576 417 -25 325 -154 67 -1734 20 984 111 881 827 460 353 693 -24 -609 1157 1434 1590 1151 1694 236 -729 775 -1843 329 424 704 831 85 1007 126 -319 -484 -1477 -1439 -848 -1756 -532 -2025 -3398 -1872 -130 145 107 917 74 361 -442 -137 -263 -199 8 301 1383 573 1837 451 -1278 -2209 -475 139 -949 -737 381 -378 1 854 557 400 1248 482 -458 -875 -77 -396 931 343 149 725 107 1241 667 -605 105 510 384 729 -202 -140 -775 6 167 -196 591 699 35 -319 -755 -1711 SS 20260115T234939.8Z 9511.992822 717 1 54.01 2 27.17 32.66 23.08 311.00 0.00 1 0.00 1 0 17 9.380e-03 7.824e-03 1.499e-03 1.129e-03 1.454746e-01 5.937391e-04 1.840975e-03 -6.000000e+00 5.502801e-03 232.17 -2.00 3.69 -2.00 314.40 0.00e+00 1.557735e-04 4.423778e-05 2.115365e-05 -6.000000e+00 2.345405e-04 278.93 -2.00 20.00 -2.00 313.90 0.00e+00 1.124 0.000 302.00 328.00 3 5.8197e+00 1.5308e-03 1.3396e-02 -6.0000e+00 1.3838e-02 2.2700e-02 1.6869e-03 7.9332e-03 -6.0000e+00 1.4944e-02 -6.8256e-03 9.6454e-04 3.8496e-03 -6.0000e+00 8.8491e-03 1.7546e-03 4.1771e-04 1.0606e-03 -6.0000e+00 3.7471e-03 4.8070e-04 2.1075e-04 3.1999e-05 1.4514e-05 -6.0000e+00 2.5801e-04 3.2135e-03 0.0000e+00 11 9 0 11 32 0 99.94 25.43 0.39 0.00321 0.00480 26 3 1 8 0 2076.900 20.00 25.43 19.27 35.25 33.75 1.0 960.79 1426 425 636 -378 -1605 -1576 -1331 -2034 926 -1510 -2346 -2523 -72 -555 508 158 -1183 930 -356 1066 402 1064 283 1061 395 1375 -194 1127 610 1335 8 1085 935 706 -1983 -1118 -2571 -1674 -333 108 -648 -140 -704 325 -366 433 -112 6 -1698 -381 830 330 775 976 485 543 515 120 470 379 1501 1280 1383 1698 647 -284 -1101 -1693 103 535 465 790 259 730 212 -304 -687 -1544 -1420 -977 -1125 -745 -1880 -2955 -1606 -153 -223 51 759 276 445 -41 -149 -443 -225 -161 50 1184 550 1069 230 -847 -1886 -484 56 -730 -480 -259 -183 172 542 721 452 629 180 -274 -479 -48 38 622 122 156 539 349 608 458 -107 190 644 588 279 -122 -151 -457 214 -28 120 147 419 31 -501 -605 -1117 552 178 268 -149 -609 -562 -493 -829 372 -652 -996 -1060 -32 -271 251 84 -653 509 -202 611 235 610 165 639 248 876 -117 675 335 747 5 598 543 422 -1137 -609 -1529 -1048 -243 86 -535 -119 -617 284 -319 371 -94 5 -1415 -306 677 285 655 859 441 498 479 112 429 344 1378 1178 1362 1759 676 -275 -1032 -1513 92 500 481 814 272 744 216 -300 -607 -1345 -1227 -864 -1107 -758 -1962 -3246 -1853 -178 -274 62 933 332 521 -47 -161 -445 -227 -175 57 1386 694 1336 275 -1009 -2126 -540 67 -901 -616 -330 -242 237 744 1001 609 825 227 -336 -571 -58 47 787 163 210 711 446 766 549 -129 219 768 740 349 -157 -198 -610 283 -39 167 210 608 45 -703 -868 -1569 SS 20260116T000532.6Z 9512.003849 727 1 54.39 2 25.82 24.92 25.25 304.52 0.00 1 0.00 1 0 17 1.893e-02 1.245e-02 3.085e-03 2.132e-03 1.454077e-01 1.116669e-03 1.812162e-03 -6.000000e+00 1.110342e-02 232.17 -2.00 3.69 -2.00 314.86 0.00e+00 -2.955986e-04 9.079890e-05 8.462140e-05 -6.000000e+00 4.733247e-04 278.93 -2.00 20.00 -2.00 314.32 0.00e+00 1.111 0.000 302.00 328.00 3 6.8856e+00 2.8857e-03 1.3247e-02 -6.0000e+00 2.7922e-02 2.4696e-02 3.1865e-03 7.8440e-03 -6.0000e+00 3.0155e-02 -9.2934e-03 1.8199e-03 3.8082e-03 -6.0000e+00 1.7856e-02 5.6227e-03 7.9818e-04 1.1031e-03 -6.0000e+00 7.5594e-03 1.6798e-04 6.3567e-04 6.0511e-05 1.4129e-05 -6.0000e+00 5.2075e-04 4.5657e-03 0.0000e+00 12 8 8 10 0 0 99.95 25.42 0.22 0.00457 0.00934 14 1 1 8 0 3884.570 20.01 25.42 19.58 35.25 33.75 1.0 961.45 4888 1651 1576 448 8698 -2639 -2373 -5589 -135 -5239 -3765 -3536 2094 -1140 -559 66 -4464 552 -3253 1623 -892 2407 -140 1346 636 2385 -911 3100 2337 -1157 -1590 1474 420 2791 -6047 1436 -1847 -3905 760 1884 -974 1920 -683 467 103 889 326 324 -3145 817 1523 -223 84 524 -320 498 412 -375 -1773 2108 2808 2297 1227 1177 -533 -754 1936 -3142 1172 578 1770 961 -65 761 102 -325 -811 -1496 -2004 -1579 -2491 -428 -1964 -3401 -2264 357 -54 -94 882 -532 -92 -1121 307 -389 -457 -110 -482 1753 377 2518 518 -778 -2890 -155 667 -930 -369 729 -157 -81 635 -11 114 973 748 -202 -1175 380 -188 1205 294 -422 835 175 1596 448 -782 -82 338 -239 950 -293 -70 -1075 35 -153 -266 -87 679 502 -177 -639 -1050 1622 604 580 154 2412 -774 -725 -1935 -49 -2086 -1438 -1331 799 -494 -265 33 -2207 287 -1645 873 -457 1283 -77 701 345 1308 -516 1718 1186 -580 -817 761 230 1532 -3376 715 -1027 -2315 508 1456 -780 1546 -578 393 86 730 262 249 -2400 635 1209 -175 68 446 -282 440 369 -338 -1592 1807 2446 2129 1231 1157 -529 -740 1681 -2726 994 550 1838 984 -68 770 106 -306 -685 -1269 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