File name: Pandora272s1_Lauder_20260116_L2Fit_fout2c2d20241202p1-8.txt File generation date: 20260116T125733.2Z 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 v1.8.75 Instrument operation file used: Pandora272_OF_v3d20240829.txt Instrument calibration file used: Pandora272s1_CF_v2d20241202.txt Level 1 file used: Pandora272s1_Lauder_20260116_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: 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: 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 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 1.200e-02 9.088e-03 1.862e-03 1.375e-03 1.487095e-01 7.255884e-04 1.877344e-03 -6.000000e+00 7.039516e-03 232.17 -2.00 3.69 -2.00 314.52 0.00e+00 1.365001e-04 5.511162e-05 2.987910e-05 -6.000000e+00 3.000997e-04 278.93 -2.00 20.00 -2.00 314.02 0.00e+00 1.145 0.000 302.00 328.00 3 5.8362e+00 1.8702e-03 1.3658e-02 -6.0000e+00 1.7702e-02 3.0226e-02 2.0599e-03 8.0931e-03 -6.0000e+00 1.9117e-02 -8.0320e-03 1.1790e-03 3.9282e-03 -6.0000e+00 1.1320e-02 1.7285e-03 5.1263e-04 1.0822e-03 -6.0000e+00 4.7956e-03 4.5941e-04 7.4817e-05 3.8953e-05 1.4742e-05 -6.0000e+00 3.3016e-04 1.5428e-02 2.2010e-05 11 9 0 11 8 0 99.04 25.43 0.23 0.01543 0.01599 15 2 1 8 0 3516.920 20.00 25.43 18.85 35.25 33.75 1.0 959.21 3367 816 851 -1179 2101 -2527 -1211 -3018 1370 -2864 -3225 -2411 500 -409 119 1034 -2354 699 -1298 1359 -152 1451 722 1372 589 2028 -503 1442 543 -530 -491 1083 566 974 -4720 -210 -1921 -2386 235 628 -619 234 -683 428 -78 331 -279 -13 -2192 18 1302 181 1040 996 522 378 743 -72 -722 1293 1616 1714 1234 1699 195 -796 806 -2114 414 484 729 786 74 938 93 -370 -550 -1735 -1685 -909 -1798 -530 -1883 -2999 -1672 -118 109 84 733 84 339 -358 -86 -229 -218 -36 212 1100 459 1554 425 -1040 -1856 -457 47 -779 -620 262 -309 -43 582 407 359 1034 484 -301 -744 -109 -392 642 228 128 571 154 1050 613 -439 90 362 248 518 -174 -114 -637 -84 49 -173 372 466 73 -173 -494 -1157 1263 335 351 -459 693 -902 -408 -1135 542 -1237 -1360 -999 217 -197 58 539 -1294 378 -733 766 -88 815 414 813 363 1176 -299 846 293 -276 -262 590 327 574 -2741 -112 -1126 -1486 168 488 -499 194 -584 365 -66 277 -229 -11 -1798 14 1037 154 915 858 465 340 675 -66 -653 1137 1450 1627 1187 1717 199 -800 725 -1857 362 470 736 835 80 982 92 -356 -506 -1488 -1437 -839 -1747 -526 -2026 -3401 -1881 -141 130 104 918 104 407 -394 -90 -238 -229 -38 247 1322 563 1880 521 -1210 -2157 -525 55 -986 -773 339 -417 -58 810 576 492 1379 625 -360 -867 -129 -498 829 310 174 767 201 1349 751 -514 108 422 305 662 -231 -145 -827 -113 67 -245 536 686 106 -246 -686 -1657 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 9.537e-03 7.862e-03 1.498e-03 1.128e-03 1.455174e-01 5.937747e-04 1.837683e-03 -6.000000e+00 5.595343e-03 232.17 -2.00 3.69 -2.00 314.40 0.00e+00 1.912606e-04 4.422883e-05 2.026514e-05 -6.000000e+00 2.384724e-04 278.93 -2.00 20.00 -2.00 313.90 0.00e+00 1.124 0.000 302.00 328.00 3 5.5398e+00 1.5308e-03 1.3391e-02 -6.0000e+00 1.4071e-02 2.2721e-02 1.6867e-03 7.9260e-03 -6.0000e+00 1.5194e-02 -6.6934e-03 9.6463e-04 3.8438e-03 -6.0000e+00 8.9970e-03 1.7309e-03 4.1810e-04 1.0599e-03 -6.0000e+00 3.8122e-03 6.3581e-04 1.6071e-04 3.1999e-05 1.4457e-05 -6.0000e+00 2.6236e-04 1.5309e-02 6.6394e-05 11 9 0 11 32 0 99.94 25.43 0.39 0.01531 0.01652 26 3 1 8 0 2076.900 20.00 25.43 19.27 35.25 33.75 1.0 960.79 1790 522 461 -979 -2162 -1661 -1114 -1723 1134 -1612 -2620 -2529 178 -281 764 260 -1209 965 -313 1097 339 979 322 1099 385 1351 -376 785 338 1273 47 1140 1042 620 -2206 -1101 -2374 -1422 -45 296 -602 -146 -714 271 -417 390 -186 -70 -1761 -392 876 381 808 1007 481 537 497 80 426 359 1516 1321 1422 1712 619 -343 -1139 -1707 133 581 491 795 247 714 188 -326 -705 -1555 -1413 -975 -1122 -742 -1881 -2961 -1613 -165 -235 43 760 295 482 -1 -109 -426 -248 -201 3 1139 537 1106 282 -788 -1848 -517 -7 -758 -507 -288 -208 133 516 735 511 719 281 -202 -475 -94 -40 551 101 173 567 414 683 519 -40 190 581 537 234 -140 -154 -491 138 -89 92 113 410 73 -460 -563 -1081 692 218 194 -387 -820 -592 -412 -702 456 -697 -1112 -1062 78 -137 377 139 -668 528 -178 630 198 561 188 662 241 861 -228 470 185 712 25 628 605 371 -1265 -599 -1412 -890 -33 235 -496 -124 -625 237 -364 334 -156 -60 -1467 -314 714 329 682 886 437 493 462 75 390 326 1392 1215 1400 1775 646 -331 -1067 -1526 119 543 508 819 259 728 192 -320 -623 -1354 -1221 -862 -1104 -755 -1962 -3253 -1862 -192 -290 52 934 356 564 -1 -118 -427 -251 -219 3 1334 677 1383 337 -939 -2083 -577 -9 -936 -651 -367 -275 184 707 1021 689 943 354 -248 -566 -115 -49 697 135 232 748 528 861 621 -48 220 693 675 292 -182 -201 -655 183 -126 128 162 596 105 -647 -808 -1519 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 1.874e-02 1.248e-02 3.084e-03 2.131e-03 1.454795e-01 1.116717e-03 1.816503e-03 -6.000000e+00 1.098752e-02 232.17 -2.00 3.69 -2.00 314.87 0.00e+00 -2.645914e-04 9.075739e-05 8.743731e-05 -6.000000e+00 4.686680e-04 278.93 -2.00 20.00 -2.00 314.33 0.00e+00 1.111 0.000 302.00 328.00 3 6.6056e+00 2.8864e-03 1.3251e-02 -6.0000e+00 2.7629e-02 2.4648e-02 3.1866e-03 7.8520e-03 -6.0000e+00 2.9842e-02 -9.0911e-03 1.8198e-03 3.8126e-03 -6.0000e+00 1.7670e-02 5.5804e-03 7.9895e-04 1.1049e-03 -6.0000e+00 7.4828e-03 2.2216e-04 6.0085e-05 6.0497e-05 1.4229e-05 -6.0000e+00 5.1564e-04 1.6273e-02 -7.2074e-05 12 8 8 10 0 0 99.95 25.42 0.22 0.01627 0.01672 14 1 1 8 0 3884.570 20.01 25.42 19.58 35.25 33.75 1.0 961.45 5293 1761 1306 -369 7985 -2694 -2108 -5138 163 -5403 -4105 -3474 2401 -805 -232 162 -4529 573 -3222 1657 -983 2292 -80 1383 645 2359 -1141 2649 1955 -1256 -1536 1552 561 2660 -6353 1435 -1561 -3516 1171 2153 -902 1920 -693 382 38 819 207 203 -3248 816 1599 -174 140 561 -315 493 385 -419 -1841 2073 2845 2373 1284 1201 -597 -874 1868 -3164 1217 676 1814 975 -78 715 49 -393 -872 -1537 -1985 -1543 -2474 -413 -1954 -3391 -2255 363 -58 -96 874 -518 -69 -1082 345 -374 -479 -145 -532 1707 370 2556 571 -707 -2840 -203 592 -965 -403 687 -194 -129 604 9 188 1078 875 -116 -1173 324 -283 1117 265 -406 876 263 1696 531 -678 -73 250 -323 892 -314 -71 -1123 -77 -236 -304 -143 664 566 -116 -581 -1003 1757 644 481 -127 2213 -790 -644 -1778 59 -2152 -1567 -1307 917 -349 -110 82 -2239 297 -1629 891 -503 1222 -44 721 350 1294 -646 1468 992 -630 -789 800 308 1460 -3547 715 -868 -2085 784 1663 -722 1546 -586 321 32 673 166 156 -2478 634 1269 -137 114 477 -277 435 344 -378 -1653 1777 2478 2199 1288 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