File name: Pandora272s1_Lauder_20260208_L2Fit_fout2c6d20241202p1-8.txt File generation date: 20260704T070402.9Z 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_20260208_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: 20260208 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 20260207T220709.7Z 9534.921640 647 1 54.27 2 46.32 63.44 66.82 271.25 0.00 1 0.00 1 0 17 2.915e-02 1.451e-02 3.948e-03 2.291e-03 1.860768e-01 1.191086e-03 2.307318e-03 -6.000000e+00 1.702640e-02 231.13 -2.00 3.69 -2.00 315.63 0.00e+00 9.858352e-06 1.132380e-04 7.573614e-05 -6.000000e+00 7.304259e-04 279.46 -2.00 20.00 -2.00 315.02 0.00e+00 1.446 0.000 302.00 328.00 3 6.5838e+00 3.0905e-03 1.7117e-02 -6.0000e+00 4.2698e-02 5.4899e-02 3.4243e-03 1.0009e-02 -6.0000e+00 4.6153e-02 -1.3419e-02 1.9682e-03 4.8633e-03 -6.0000e+00 2.7361e-02 7.0738e-03 8.9058e-04 1.3483e-03 -6.0000e+00 1.1608e-02 1.5046e-04 5.6851e-04 6.6036e-05 1.6925e-05 -6.0000e+00 8.0176e-04 7.6474e-03 0.0000e+00 12 9 8 11 8 0 99.99 25.37 -0.41 0.00765 0.01192 21 2 1 8 0 2583.730 20.00 25.37 21.45 35.25 34.00 0.9 969.47 6735 -3479 3323 2840 16925 -3996 -7198 -10437 -467 -10499 -5601 -2525 2606 -505 -467 1127 -4887 3235 -3133 942 -462 4320 -2089 3153 1346 2037 -785 4349 1973 -2125 -3041 3423 715 3817 -8583 4680 -2729 -3186 715 2245 -298 3557 -1367 113 218 2330 723 376 -4297 1673 1397 430 -490 490 -31 -442 549 -913 -2346 2158 2948 2235 1128 1739 -351 -1132 2481 -3704 1032 359 1113 1012 -196 1479 -213 -1312 127 -1725 -3071 -1333 -2033 -850 -2402 -3376 -1896 94 148 172 1284 -355 358 -913 -1520 -353 -776 -1020 -481 2215 288 2607 45 -1091 -3084 472 1084 -446 -503 1331 -403 -116 786 322 -260 1478 1067 24 -1179 131 -368 722 27 -273 1275 34 1662 421 -1292 27 -246 -577 417 -325 555 -750 -99 71 -49 431 383 224 -259 -733 -974 1681 -940 849 744 3381 -935 -1824 -3004 -134 -3182 -1581 -761 812 -164 -169 435 -2058 1281 -1361 403 -203 1788 -936 1403 633 980 -389 1913 812 -880 -1313 1451 331 1760 -4179 1927 -1310 -1757 412 1490 -222 2645 -1095 90 172 1784 549 275 -3187 1151 1000 329 -396 411 -25 -360 450 -758 -1938 1830 2541 1901 1043 1693 -348 -1040 2180 -3311 904 327 1111 1064 -210 1517 -209 -1175 109 -1396 -2535 -1190 -1882 -856 -2634 -3620 -2135 112 185 224 1674 -458 424 -999 -1638 -352 -792 -1133 -544 2694 382 3358 56 -1289 -3474 556 1280 -569 -670 1824 -546 -165 1161 486 -381 1990 1413 30 -1434 162 -487 1021 38 -379 1717 49 2170 529 -1564 34 -299 -745 557 -453 775 -1083 -139 106 -75 676 612 354 -397 -1096 -1419 SS 20260207T223011.3Z 9534.937631 663 1 7.21 2 42.79 57.31 70.74 267.26 0.00 1 0.00 1 0 17 1.555e-02 1.086e-02 7.395e-03 5.077e-03 1.759367e-01 2.655055e-03 2.226873e-03 -6.000000e+00 9.088846e-03 231.13 -2.00 3.69 -2.00 314.89 0.00e+00 3.376609e-04 2.185028e-04 3.295169e-05 -6.000000e+00 3.897136e-04 279.46 -2.00 20.00 -2.00 314.36 0.00e+00 1.361 0.000 302.00 328.00 3 5.7900e+00 6.8471e-03 1.6194e-02 -6.0000e+00 2.2793e-02 5.2139e-02 7.5651e-03 9.5663e-03 -6.0000e+00 2.4633e-02 -1.0223e-02 4.3300e-03 4.6501e-03 -6.0000e+00 1.4603e-02 5.5681e-03 1.9125e-03 1.2994e-03 -6.0000e+00 6.1997e-03 3.6707e-04 6.3294e-04 1.4375e-04 1.7016e-05 -6.0000e+00 4.2770e-04 3.6792e-03 0.0000e+00 12 9 9 12 1 1 999.00 25.37 0.13 0.00368 0.00844 1 2 1 8 0 3603.130 20.00 25.37 22.40 35.25 34.00 0.9 973.46 667 219 -536 1863 4021 -1866 -593 -6594 2313 -6705 -3160 -1600 -1050 207 -1736 112 -2197 1567 -2050 2485 -206 2603 1669 723 1078 2865 417 2840 -255 -173 596 1731 439 1328 -5354 -2021 -1874 -2187 -172 1203 -380 315 -459 379 -449 -166 1331 -629 -2761 1039 885 438 790 1579 -326 839 603 758 -832 -128 1781 694 375 2165 1862 -528 697 -1568 -303 1117 1403 302 -342 686 162 -837 -164 -675 -703 -2437 -870 -915 -3424 -3599 -1404 -755 276 627 450 -33 186 -554 -239 -807 -214 -190 -75 1285 1169 1163 6 -1134 -2221 -175 574 -106 -914 157 -346 259 915 1040 432 337 571 -548 97 88 -208 813 -245 -167 1160 19 897 730 -982 467 493 675 281 -204 19 -891 250 -672 298 310 148 780 -897 -526 -1276 216 77 -191 603 1218 -567 -186 -2204 779 -2592 -1152 -572 -406 88 -771 53 -1090 762 -1063 1265 -109 1322 867 395 608 1633 226 1519 -128 -84 295 887 242 745 -2999 -1054 -1053 -1306 -119 897 -295 252 -380 313 -372 -136 1048 -485 -2241 798 703 346 651 1353 -293 754 550 690 -755 -115 1600 630 366 2201 1895 -506 641 -1405 -274 1048 1450 314 -362 699 165 -779 -144 -589 -615 -2232 -823 -952 -3701 -4063 -1564 -900 344 768 560 -40 221 -636 -249 -834 -223 -202 -88 1557 1444 1429 7 -1328 -2593 -201 673 -133 -1149 204 -471 350 1289 1487 602 460 748 -669 114 106 -269 1070 -341 -233 1568 26 1163 900 -1167 560 615 842 368 -264 25 -1195 348 -953 433 461 225 1160 -1313 -746 -1771 SS 20260207T223446.1Z 9534.940811 666 1 4.55 2 42.11 56.02 71.52 266.47 0.00 1 0.00 1 0 17 8.072e-03 6.969e-03 6.769e-04 5.241e-04 1.696880e-01 2.756344e-04 2.173306e-03 -6.000000e+00 4.716660e-03 231.13 -2.00 3.69 -2.00 314.27 0.00e+00 3.912673e-04 2.019554e-05 1.478253e-05 -6.000000e+00 2.022723e-04 279.46 -2.00 20.00 -2.00 313.79 0.00e+00 1.346 0.000 302.00 328.00 3 1.6868e+00 7.0742e-04 1.5895e-02 -6.0000e+00 1.1828e-02 2.4757e-02 7.7944e-04 9.2786e-03 -6.0000e+00 1.2784e-02 -2.1191e-03 4.4663e-04 4.5124e-03 -6.0000e+00 7.5788e-03 -2.3496e-03 1.9359e-04 1.2671e-03 -6.0000e+00 3.2168e-03 2.3023e-02 7.0432e-05 1.4779e-05 1.7351e-05 -6.0000e+00 2.2201e-04 4.8647e-03 0.0000e+00 12 9 1 12 1 1 98.54 25.37 0.38 0.00486 0.00539 81 102 2 8 0 55.450 19.99 25.37 22.77 35.25 34.00 0.9 975.35 -328 -66 48 -1275 -1785 -1305 -645 200 972 -262 -1092 -1274 -1053 -249 525 369 162 340 772 1104 1082 493 1230 826 425 885 378 -83 -34 520 840 1182 1486 -58 -2076 -1947 -2430 -1656 -637 -516 -827 -719 -662 365 -403 -269 -411 -537 -824 -490 503 563 858 1097 683 741 888 538 379 351 780 952 1390 1764 755 -152 -447 -801 -150 652 475 610 387 610 230 -61 -421 -1105 -937 -807 -1220 -1170 -1876 -2636 -1062 -673 -250 220 560 476 351 161 -256 -332 -8 111 520 1032 601 196 15 -782 -1351 -524 -436 -725 -592 -479 -329 297 583 584 435 250 -161 -251 -139 49 348 510 100 316 372 381 411 492 151 525 517 362 400 86 -241 -280 76 86 -56 329 76 -249 -229 -590 -988 -141 -29 21 -536 -729 -500 -256 82 418 -120 -493 -573 -490 -123 274 201 91 193 450 635 631 286 716 504 260 555 239 -51 -20 291 483 707 905 -36 -1262 -1179 -1536 -1102 -464 -401 -686 -602 -569 314 -346 -229 -343 -443 -676 -393 413 475 733 953 615 673 816 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