File name: Pandora272s1_Lauder_20251127_L2Fit_fout2c2d20241202p1-8.txt File generation date: 20251127T124117.2Z 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_20251127_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: 20251127 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 20251126T213214.2Z 9461.897387 800 1 8.61 2 43.29 71.35 99.65 125.66 0.00 1 0.00 1 0 17 9.147e-03 7.556e-03 2.608e-03 1.815e-03 1.882328e-01 9.489085e-04 2.402139e-03 -6.000000e+00 5.342064e-03 230.86 -2.00 3.69 -2.00 314.87 0.00e+00 4.686599e-04 7.650999e-05 3.177136e-05 -6.000000e+00 2.266055e-04 276.69 -2.00 20.00 -2.00 314.37 0.00e+00 1.372 0.000 302.00 328.00 3 4.3114e+00 2.4467e-03 1.6684e-02 -6.0000e+00 1.3401e-02 1.8071e-02 2.7016e-03 1.0253e-02 -6.0000e+00 1.4489e-02 -4.3793e-03 1.5459e-03 4.9999e-03 -6.0000e+00 8.5774e-03 -1.4780e-03 6.8172e-04 1.4090e-03 -6.0000e+00 3.6388e-03 1.5747e-03 6.0506e-05 5.1414e-05 1.8463e-05 -6.0000e+00 2.5149e-04 1.2194e-02 5.8219e-05 12 9 1 12 1 1 99.84 25.44 0.29 0.01219 0.01265 9 7 1 8 0 860.800 20.00 25.44 20.69 35.25 34.00 1.0 968.68 -620 416 -48 -1197 -403 -2383 -776 -1299 540 -636 -2144 -1537 -238 4 366 112 -195 463 296 917 916 977 1172 557 632 1496 134 3 -344 349 923 1392 1365 1030 -2619 -2092 -2775 -2466 -181 216 -1152 -190 -694 396 -305 -189 -349 -260 -1351 -560 674 505 728 1301 791 611 1026 25 102 793 1039 1434 1301 1802 667 -340 136 -1210 -279 438 516 796 666 578 244 -422 -584 -1646 -1129 -1085 -1207 -734 -1629 -2596 -1383 -583 15 394 539 655 1 83 -329 -359 -433 -317 606 1039 710 541 -37 -938 -1804 -541 -405 -979 -653 -326 -302 200 696 724 483 355 67 -288 -155 36 -221 634 134 253 673 395 729 651 159 390 417 314 464 -64 -214 -310 143 112 -147 205 70 -164 -202 -505 -1118 -207 148 -17 -411 -130 -744 -249 -428 193 -241 -811 -578 -96 2 161 54 -97 234 154 460 467 492 596 298 350 848 77 2 -183 177 483 761 748 585 -1446 -1103 -1589 -1517 -122 162 -914 -155 -560 320 -247 -151 -287 -206 -1048 -424 521 415 597 1113 703 526 892 22 88 705 901 1313 1230 1802 651 -322 123 -1101 -246 409 512 833 707 598 248 -409 -532 -1400 -955 -1006 -1148 -736 -1772 -2862 -1543 -695 18 476 662 812 1 95 -356 -377 -442 -351 704 1236 881 672 -46 -1128 -2040 -625 -488 -1225 -820 -428 -399 275 972 1034 672 478 86 -353 -191 44 -287 851 183 346 903 532 957 812 196 465 516 397 595 -85 -290 -414 200 161 -212 302 105 -245 -292 -736 -1591 SS 20251126T213304.8Z 9461.897973 802 1 7.89 2 43.15 71.15 99.54 125.50 0.00 1 0.00 1 0 17 1.404e-02 9.748e-03 5.969e-03 3.791e-03 1.886129e-01 1.976925e-03 2.370215e-03 -6.000000e+00 8.201792e-03 230.86 -2.00 3.69 -2.00 315.24 0.00e+00 5.027447e-04 1.721025e-04 2.486594e-05 -6.000000e+00 3.478151e-04 276.69 -2.00 20.00 -2.00 314.71 0.00e+00 1.369 0.000 302.00 328.00 3 5.4012e+00 5.1110e-03 1.6633e-02 -6.0000e+00 2.0575e-02 2.5049e-02 5.6513e-03 1.0203e-02 -6.0000e+00 2.2244e-02 -4.8000e-03 3.2400e-03 4.9686e-03 -6.0000e+00 1.3168e-02 -1.3874e-03 1.4513e-03 1.4155e-03 -6.0000e+00 5.5878e-03 5.2921e-04 3.6918e-04 1.0789e-04 1.7489e-05 -6.0000e+00 3.8596e-04 1.1486e-02 1.1209e-04 12 9 9 12 33 1 99.79 25.44 0.12 0.01149 0.01426 3 3 1 8 0 1971.340 20.00 25.44 20.80 35.00 33.75 1.0 969.06 -2538 2168 1168 -3567 -1675 -843 922 -3318 1410 -1326 -4463 -251 -3300 -1881 1480 1433 -355 3176 -220 1499 1206 1231 -815 517 2468 2826 300 29 -2627 -324 24 2066 2009 -2120 -3965 -549 -4735 -2543 503 203 -1356 929 -493 572 -713 1219 521 434 -1021 -515 477 1476 574 166 460 1126 1114 -195 -1825 1253 1213 1535 2255 2058 67 268 -1278 -1256 -348 520 197 1182 692 938 382 -1122 -571 -2061 -262 -1371 -2535 -133 -2172 -3015 -1708 -92 -360 529 764 -263 779 115 -154 -697 -655 -625 196 1515 884 1520 -305 -783 -1722 -466 620 -905 -252 93 -708 234 399 191 268 855 447 388 -1041 -129 958 305 -351 103 862 355 206 637 304 -307 314 -6 33 -84 300 -138 -50 41 -422 358 212 213 -162 -661 -972 -727 640 354 -1059 -468 -221 248 -938 420 -427 -1455 -79 -1159 -728 620 604 -157 1386 -103 706 578 583 -399 261 1267 1490 163 15 -1266 -147 11 995 1030 -1171 -2092 -269 -2604 -1449 329 146 -1019 710 -393 456 -572 954 402 323 -795 -392 372 1134 466 142 405 996 941 -167 -1561 1095 1083 1364 2142 1967 66 256 -1134 -1130 -316 492 196 1228 731 964 372 -1064 -513 -1737 -216 -1258 -2473 -132 -2365 -3273 -1946 -111 -438 663 971 -331 947 128 -165 -701 -667 -689 224 1797 1136 1940 -377 -955 -1978 -527 752 -1132 -327 119 -958 330 563 277 376 1171 591 472 -1312 -157 1227 405 -491 144 1177 472 271 792 379 -373 394 -7 44 -116 398 -187 -71 59 -633 546 330 328 -242 -967 -1385 SS 20251126T213419.3Z 9461.898835 804 1 54.24 2 42.94 70.85 99.37 125.27 0.00 1 0.00 1 0 17 8.440e-03 7.041e-03 6.820e-04 4.850e-04 1.882665e-01 2.536039e-04 2.393756e-03 -6.000000e+00 4.929601e-03 230.86 -2.00 3.69 -2.00 314.75 0.00e+00 3.841855e-04 2.006245e-05 2.772816e-05 -6.000000e+00 2.090777e-04 276.69 -2.00 20.00 -2.00 314.27 0.00e+00 1.364 0.000 302.00 328.00 3 3.6459e+00 6.5301e-04 1.6613e-02 -6.0000e+00 1.2366e-02 2.0930e-02 7.2153e-04 1.0223e-02 -6.0000e+00 1.3370e-02 -4.8944e-03 4.1289e-04 4.9828e-03 -6.0000e+00 7.9148e-03 -1.2687e-03 1.8113e-04 1.3950e-03 -6.0000e+00 3.3582e-03 3.0829e-03 9.8466e-05 1.3667e-05 1.8486e-05 -6.0000e+00 2.3203e-04 1.1736e-02 8.1817e-05 11 8 0 10 0 0 99.98 25.44 0.35 0.01174 0.01248 164 17 1 8 0 330.720 19.99 25.44 20.88 35.25 33.75 1.0 969.41 -494 226 -3 -1827 -1239 -1555 -816 -388 851 -609 -1719 -1233 -620 -456 626 611 28 725 473 1175 885 752 1017 814 505 951 335 -172 -482 279 931 1177 1500 322 -2706 -2003 -2527 -1638 -336 -92 -749 -468 -683 304 -536 -208 -383 -509 -1054 -460 565 616 898 970 751 650 1036 347 201 349 734 1041 1385 1771 735 -278 -230 -1093 -130 627 627 723 501 648 283 -33 -690 -1366 -1106 -916 -1188 -1139 -1724 -2528 -1193 -612 -222 257 640 484 357 330 -228 -396 -145 36 439 913 721 351 5 -784 -1555 -644 -425 -708 -607 -464 -382 214 636 630 484 311 -64 -142 -266 16 121 542 136 379 518 365 614 602 32 340 414 208 328 26 -172 -331 -26 59 -108 281 145 -119 -216 -498 -946 -172 84 -1 -660 -419 -500 -272 -132 316 -241 -677 -482 -246 -202 289 307 14 362 244 620 476 400 546 458 280 542 193 -99 -254 149 483 639 863 184 -1575 -1111 -1438 -1001 -228 -70 -603 -374 -563 251 -443 -171 -307 -412 -828 -353 445 492 750 849 653 572 923 312 177 305 653 941 1343 1750 738 -270 -212 -972 -117 600 640 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