File name: Pandora272s1_Lauder_20260129_L2Fit_fout2c6d20241202p1-8.txt File generation date: 20260704T070250.6Z 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_20260129_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: 20260129 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 20260128T193129.0Z 9524.813530 464 1 23.03 2 70.88 96.68 156.28 230.63 0.00 1 0.00 1 0 17 9.431e-02 1.483e-02 1.924e-02 3.403e-03 3.428941e-01 1.749612e-03 4.230396e-03 -6.000000e+00 5.520746e-02 231.59 -2.00 3.69 -2.00 318.16 0.00e+00 -5.188769e-04 3.141078e-04 2.672941e-04 -6.000000e+00 2.361024e-03 279.23 -2.00 20.00 -2.00 317.50 0.00e+00 3.016 0.000 302.00 328.00 3 4.7949e+00 4.7151e-03 3.4409e-02 -6.0000e+00 1.3862e-01 1.0571e-02 5.3164e-03 1.8914e-02 -6.0000e+00 1.4976e-01 -1.6735e-02 3.4414e-03 9.1855e-03 -6.0000e+00 8.8738e-02 1.1840e-02 1.7640e-03 2.5678e-03 -6.0000e+00 3.7627e-02 1.6617e-04 7.9778e-04 9.8465e-05 2.7636e-05 -6.0000e+00 2.5939e-03 3.8226e-03 0.0000e+00 12 9 9 12 9 1 99.18 25.40 0.12 0.00382 0.00982 7 2 1 8 0 2877.640 20.00 25.40 24.60 35.25 33.75 0.8 981.85 14461 -8472 -1986 3662 63770 -12498 -23778 -49158 -13103 -37649 -28701 -14261 18282 -1726 -7067 342 -16474 6777 -7648 1664 -3209 7610 -2717 5063 -880 8741 -3681 5479 3966 -3607 -5143 7413 914 10246 -17267 11317 -1100 -3500 1953 3918 -542 8037 -884 1384 2339 3258 1364 2915 -3588 3591 4005 891 1127 148 1713 -302 692 -255 -2689 3802 3848 2516 180 1677 -301 -680 3987 -3535 2340 845 667 553 -1304 1024 -1296 -1500 -864 -1050 -3258 -1873 -1786 -305 -3447 -3647 -1938 -405 -490 313 710 -297 747 -905 -78 -291 -979 247 120 1836 -267 1973 200 -921 -2817 -908 802 -952 -470 930 -339 -144 480 90 -127 713 1211 197 -762 -46 -485 659 -12 120 1186 139 1850 1077 -473 338 559 123 823 -140 11 -504 222 302 -551 -107 440 -66 -501 -733 -871 686 -562 -129 213 1820 -742 -1696 -5073 -1061 -4185 -2943 -1320 1395 -187 -938 47 -2619 989 -1358 281 -581 1235 -506 936 -166 1732 -762 1080 740 -724 -1133 1577 207 2229 -4693 2482 -272 -1027 654 1532 -226 3247 -405 631 1054 1458 617 1279 -1671 1579 1867 464 625 88 1057 -180 419 -157 -1658 2353 2438 1597 128 1274 -238 -509 2680 -2517 1647 683 558 489 -1185 879 -1064 -1200 -622 -719 -2362 -1510 -1519 -286 -3383 -3772 -2106 -467 -559 368 842 -347 857 -970 -76 -295 -976 270 137 2324 -353 2551 265 -1149 -3313 -1113 980 -1262 -610 1259 -492 -210 749 146 -203 1073 1780 273 -1044 -65 -727 988 -18 184 1771 214 2658 1490 -674 470 776 186 1242 -225 18 -858 376 543 -979 -194 806 -120 -917 -1296 -1489 SS 20260128T193757.2Z 9524.818023 473 1 54.26 2 69.74 95.58 157.11 227.92 0.00 1 0.00 1 0 17 2.834e-02 7.798e-03 3.464e-03 9.763e-04 3.306785e-01 5.033085e-04 4.107823e-03 -6.000000e+00 1.658583e-02 231.59 -2.00 3.69 -2.00 317.45 0.00e+00 2.854003e-04 7.416435e-05 1.784040e-04 -6.000000e+00 7.094291e-04 279.23 -2.00 20.00 -2.00 316.79 0.00e+00 2.858 0.000 302.00 328.00 3 3.6498e+00 1.3387e-03 3.2761e-02 -6.0000e+00 4.1644e-02 1.6186e-02 1.4961e-03 1.8135e-02 -6.0000e+00 4.4994e-02 -9.4392e-03 9.1365e-04 8.7972e-03 -6.0000e+00 2.6661e-02 2.9255e-03 4.5603e-04 2.4400e-03 -6.0000e+00 1.1302e-02 6.1016e-04 3.3858e-05 2.7935e-05 2.6865e-05 -6.0000e+00 7.7948e-04 5.0658e-03 0.0000e+00 11 8 0 10 0 0 99.86 25.40 0.35 0.00507 0.00532 67 7 1 8 0 809.750 20.01 25.40 24.84 35.25 33.75 0.8 983.27 -4979 -4613 -6244 583 10920 -7357 -10661 -16337 -3834 -11647 -8778 -7762 -1664 -797 -1843 985 -3873 2236 -1415 1800 1007 2059 40 2492 748 2797 -1026 1548 -206 -1111 -1479 2422 1183 2170 -1508 -9 -3512 -2665 -164 519 -468 1269 -1189 269 42 1172 231 206 -1981 383 1225 738 872 1202 972 675 994 318 -402 1255 1716 1296 1219 1905 846 -383 383 -1575 371 444 452 784 146 833 73 -246 -785 -1476 -1728 -1152 -1392 -1134 -2179 -2720 -1431 -695 -281 145 825 379 449 -51 -93 -188 -321 -251 190 1175 543 579 -94 -900 -1925 -539 -160 -601 -539 -174 -255 317 809 451 142 401 -56 -109 -220 112 213 507 198 168 587 345 744 438 -122 326 309 165 441 64 -137 -347 31 65 -184 395 220 -51 -360 -542 -915 -454 -467 -609 56 842 -657 -1049 -1898 -441 -1411 -1041 -947 -218 -120 -327 191 -842 481 -333 427 226 497 9 604 195 746 -289 404 -51 -277 -399 687 373 714 -489 -3 -1231 -988 -71 247 -234 658 -656 149 23 645 128 112 -1091 209 701 459 541 792 672 480 679 220 -274 884 1232 941 968 1540 707 -306 301 -1234 298 379 407 743 141 772 64 -206 -632 -1133 -1369 -963 -1256 -1084 -2287 -2874 -1592 -789 -335 171 983 442 510 -55 -99 -192 -341 -280 226 1484 718 768 -119 -1118 -2335 -640 -195 -788 -708 -241 -356 453 1234 689 214 594 -80 -152 -300 157 305 743 302 254 866 512 1043 612 -164 427 428 237 650 99 -210 -551 50 107 -316 690 391 -89 -608 -917 -1501 SS 20260128T194309.5Z 9524.821637 476 1 8.11 2 68.82 94.69 157.74 225.62 0.00 1 0.00 1 0 17 3.229e-02 8.673e-03 1.010e-02 3.043e-03 3.179632e-01 1.565964e-03 3.953999e-03 -6.000000e+00 1.890250e-02 231.59 -2.00 3.69 -2.00 317.33 0.00e+00 2.585547e-04 2.220192e-04 1.875439e-04 -6.000000e+00 8.083674e-04 279.23 -2.00 20.00 -2.00 316.66 0.00e+00 2.742 0.000 302.00 328.00 3 3.9709e+00 4.1632e-03 3.1451e-02 -6.0000e+00 4.7461e-02 1.9144e-02 4.6498e-03 1.7419e-02 -6.0000e+00 5.1276e-02 -9.6345e-03 2.8094e-03 8.4511e-03 -6.0000e+00 3.0383e-02 2.8223e-03 1.3930e-03 2.3429e-03 -6.0000e+00 1.2884e-02 5.0067e-04 3.1309e-04 8.7011e-05 2.5678e-05 -6.0000e+00 8.8809e-04 3.5112e-03 0.0000e+00 12 9 1 12 33 1 63.15 25.40 0.27 0.00351 0.00586 6 5 1 8 0 1157.760 19.99 25.40 25.06 35.25 33.75 0.8 983.79 -6086 2172 -8427 5148 10011 -7987 -11552 -19852 2435 -16028 -7616 -7673 -1145 1295 -733 113 -3395 3225 -3467 3788 1375 2121 2398 2055 290 2777 -517 1478 -642 -1910 -2917 1280 -89 2924 -1899 521 -4034 -2318 -84 1487 -1135 1065 -1258 563 750 758 -412 -95 -1314 -83 680 1052 1161 1054 785 1076 1411 -78 -381 1558 1511 1408 1343 2338 129 -477 831 -1776 765 468 142 830 -100 783 -117 -142 -685 -1426 -1729 -983 -1799 -1069 -1688 -2713 -1801 -625 -150 107 1126 278 802 -447 110 13 -77 -491 272 810 320 689 131 -1311 -2230 -210 -221 -793 -817 -392 -208 280 833 714 281 268 138 -78 -75 248 -180 1044 121 308 582 390 364 631 -249 209 630 320 706 -345 34 -259 31 54 -241 86 -42 -120 -175 -228 -971 -619 226 -923 515 853 -785 -1251 -2367 286 -2205 -968 -1010 -160 205 -137 24 -779 727 -878 929 354 539 625 525 80 776 -151 404 -167 -499 -827 379 -29 981 -634 165 -1456 -876 -37 716 -624 603 -706 316 419 425 -231 -52 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