File name: Pandora131s1_Palau_20250903_L2Fit_fout2c11d20221208p1-8.txt File generation date: 20250903T151256.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c11p1-8 Local principal investigator: Katrin Mueller Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 131 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora131_OF_v3d20200610.txt Instrument calibration file used: Pandora131s1_CF_v11d20221208.txt Level 1 file used: Pandora131s1_Palau_20250903_L1_smca1c11d20221208p1-8.txt Full location name: Palau Atmospheric Observatory Short location name: Palau Country of location: Palau Location latitude [deg]: 7.3420 Location longitude [deg]: 134.4722 Location altitude [m]: 23 Local noon date: 20250903 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, radiometric temperature correction, matrix method stray light correction (replaced by simple method) Data caveats: 1st VP, year 2023 First and last pixel inside fitting window: 228 370 Nominal wavelengths inside fitting window [nm]: 305.0440 305.1849 305.3259 305.4668 305.6077 305.7486 305.8895 306.0303 306.1712 306.3121 306.4529 306.5937 306.7346 306.8754 307.0162 307.1569 307.2977 307.4385 307.5792 307.7200 307.8607 308.0014 308.1421 308.2828 308.4235 308.5642 308.7048 308.8455 308.9861 309.1268 309.2674 309.4080 309.5486 309.6892 309.8297 309.9703 310.1108 310.2514 310.3919 310.5324 310.6729 310.8134 310.9539 311.0944 311.2348 311.3753 311.5157 311.6561 311.7966 311.9370 312.0774 312.2177 312.3581 312.4985 312.6388 312.7791 312.9195 313.0598 313.2001 313.3404 313.4807 313.6209 313.7612 313.9014 314.0417 314.1819 314.3221 314.4623 314.6025 314.7426 314.8828 315.0230 315.1631 315.3032 315.4434 315.5835 315.7236 315.8636 316.0037 316.1438 316.2838 316.4239 316.5639 316.7039 316.8439 316.9839 317.1239 317.2639 317.4038 317.5438 317.6837 317.8236 317.9636 318.1035 318.2433 318.3832 318.5231 318.6629 318.8028 318.9426 319.0824 319.2223 319.3621 319.5018 319.6416 319.7814 319.9211 320.0609 320.2006 320.3403 320.4800 320.6197 320.7594 320.8991 321.0387 321.1784 321.3180 321.4577 321.5973 321.7369 321.8765 322.0160 322.1556 322.2952 322.4347 322.5743 322.7138 322.8533 322.9928 323.1323 323.2717 323.4112 323.5507 323.6901 323.8295 323.9689 324.1084 324.2477 324.3871 324.5265 324.6659 324.8052 324.9445 --------------------------------------------------------------------------------------- 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 20250902T214737.7Z 9376.908075 87 1 50.18 2 77.71 83.82 153.65 217.51 0.00 1 0.00 1 0 17 8.002e-02 4.318e-03 4.284e-02 1.365e-03 4.916334e-01 6.847840e-04 4.895901e-03 -6.000000e+00 4.394093e-02 227.94 -2.00 3.05 -2.00 320.59 0.00e+00 2.326823e-04 2.776510e-04 5.203926e-04 -6.000000e+00 2.043743e-03 294.33 -2.00 20.00 -2.00 319.78 0.00e+00 4.559 0.000 302.00 328.00 3 4.5597e-01 2.2117e-03 5.0117e-02 -6.0000e+00 1.0891e-01 2.4678e-02 2.8599e-03 2.2863e-02 -6.0000e+00 1.1832e-01 2.0802e-02 2.5212e-03 1.1055e-02 -6.0000e+00 7.0924e-02 -1.8723e-02 1.2697e-03 3.4320e-03 -6.0000e+00 3.0662e-02 2.1926e-03 -2.2116e-04 3.6649e-05 2.8514e-05 -6.0000e+00 1.9295e-03 2.1973e-02 0.0000e+00 11 1 0 11 8 0 93.72 17.94 0.13 0.02197 0.02031 376 82 1 8 0 130.980 20.00 17.94 33.05 26.21 26.11 31.2 989.13 -41174 -15153 -17839 -2370 -41386 -27276 -46661 -1639 -22012 2435 -9478 -22288 -11671 -11452 -11259 -8444 -1887 -7680 -274 -830 478 65 -3773 2536 -7468 -3265 -3369 2578 -2973 -1187 4028 -574 2598 -2095 123 -4494 -2588 -1971 -950 -1026 -846 666 -1572 -1240 409 -354 -1011 -487 -56 -686 975 -534 870 160 286 111 458 486 169 322 248 1629 1133 1883 671 245 -282 -719 445 545 633 -92 64 577 385 -65 -543 -178 -651 263 -355 -560 -1494 -1512 -914 -628 -6 43 779 872 1225 672 1216 1015 872 678 340 651 349 171 -372 -954 -863 -510 -667 -904 -821 -926 -343 -114 97 -1 299 90 -130 -17 -16 109 -122 15 -233 -124 67 121 541 302 447 300 677 490 405 61 -340 -274 -65 -76 -43 65 47 -15 45 -217 -225 -404 -132 -171 -19 -431 -241 -553 -15 -280 26 -117 -340 -180 -220 -265 -226 -52 -243 -9 -28 16 2 -141 99 -354 -158 -165 113 -132 -54 200 -35 176 -146 8 -317 -199 -169 -101 -130 -120 99 -251 -200 65 -58 -168 -82 -10 -123 190 -118 206 41 78 31 134 141 48 89 71 509 402 738 275 95 -104 -269 183 263 335 -51 35 300 184 -28 -214 -69 -281 133 -209 -373 -1088 -1155 -746 -548 -6 41 728 783 1014 515 867 734 703 628 360 779 453 220 -444 -1020 -855 -524 -755 -1080 -1028 -1226 -489 -166 154 -1 481 138 -198 -24 -24 168 -188 25 -378 -193 108 190 811 433 607 423 1071 865 715 113 -649 -555 -140 -174 -101 154 111 -33 96 -444 -449 SS 20250902T215645.2Z 9376.914412 90 1 3.98 2 75.46 84.05 154.92 214.20 0.00 1 0.00 1 0 17 8.435e-02 6.918e-03 7.036e-02 4.953e-03 4.329979e-01 2.432311e-03 4.399160e-03 -6.000000e+00 4.631880e-02 227.94 -2.00 3.05 -2.00 319.33 0.00e+00 -1.569618e-04 6.613015e-04 4.866426e-04 -6.000000e+00 2.154252e-03 294.33 -2.00 20.00 -2.00 318.42 0.00e+00 3.898 0.000 302.00 328.00 3 1.9266e+00 6.9342e-03 4.3106e-02 -6.0000e+00 1.1480e-01 4.5669e-02 8.2454e-03 1.9868e-02 -6.0000e+00 1.2472e-01 -2.3423e-03 6.2152e-03 9.5283e-03 -6.0000e+00 7.4760e-02 -6.8510e-03 3.3031e-03 2.6436e-03 -6.0000e+00 3.2323e-02 9.9624e-04 -1.4387e-04 1.2897e-04 2.3737e-05 -6.0000e+00 2.0337e-03 2.1408e-02 0.0000e+00 12 9 1 12 1 1 93.16 17.94 0.16 0.02141 0.02033 7 22 4 8 0 496.320 19.99 17.94 34.10 26.21 26.11 31.3 994.57 64179 -30501 -114 -34961 3418 -26329 -20868 -255 -12150 3911 -32032 13936 -2289 10684 -9192 6354 -6825 -4201 7579 -5256 6962 -7255 8113 -8045 2926 -3696 -2091 -4252 -6688 4543 -333 1816 -1560 -1018 -3442 -1554 -1243 -3401 3680 30 1512 373 -1068 -1236 1164 1136 -2569 -1482 -1607 3693 -693 -567 -128 1576 1436 1666 1740 487 695 -1052 2118 586 2814 2169 -305 214 -1806 107 -807 1172 -655 78 395 494 313 -723 65 -1906 -836 -739 -446 -268 -1236 -326 -1051 -479 67 831 627 601 222 -1286 -790 -746 538 -419 874 1041 1046 -672 -552 -867 -288 -348 -1083 -669 -551 -670 -329 673 607 -82 1028 232 544 -872 -743 -30 104 514 94 614 -122 248 378 326 -259 484 540 28 300 -443 -772 -180 -138 -362 -299 423 428 470 71 -90 -748 695 -884 -3 -1061 66 -646 -532 -6 -379 113 -1288 391 -88 439 -540 368 -478 -308 529 -434 531 -625 629 -791 283 -401 -225 -444 -681 424 -36 222 -221 -151 -488 -212 -186 -616 761 8 410 108 -324 -380 352 348 -813 -466 -511 1157 -244 -218 -52 675 640 765 821 232 322 -489 987 299 1547 1297 -190 126 -1026 60 -493 798 -487 59 299 361 215 -457 38 -1114 -521 -522 -350 -230 -1127 -305 -1045 -500 72 915 690 645 226 -1245 -722 -684 525 -451 1018 1318 1395 -898 -700 -1021 -322 -402 -1343 -859 -728 -919 -472 1022 970 -135 1644 359 797 -1245 -1067 -45 161 826 152 970 -190 376 558 467 -360 682 817 46 506 -767 -1364 -329 -264 -713 -596 850 863 928 135 -167 -1377 SS 20250902T220537.3Z 9376.920571 92 1 52.03 2 73.27 84.28 156.05 210.63 0.00 1 0.00 1 0 17 1.874e-02 4.546e-03 6.230e-03 5.638e-04 3.779036e-01 2.766784e-04 3.873828e-03 -6.000000e+00 1.028983e-02 227.94 -2.00 3.05 -2.00 319.47 0.00e+00 1.293597e-04 7.714823e-05 1.891769e-04 -6.000000e+00 4.785702e-04 294.33 -2.00 20.00 -2.00 318.55 0.00e+00 3.419 0.000 302.00 328.00 3 2.6902e-01 7.9743e-04 3.7769e-02 -6.0000e+00 2.5504e-02 2.8272e-02 9.5129e-04 1.7291e-02 -6.0000e+00 2.7707e-02 4.8302e-03 7.0247e-04 8.3370e-03 -6.0000e+00 1.6608e-02 -8.7512e-03 3.7037e-04 2.3399e-03 -6.0000e+00 7.1807e-03 8.8940e-03 -1.1593e-04 1.5184e-05 2.2513e-05 -6.0000e+00 4.5178e-04 2.1346e-02 0.0000e+00 10 0 0 10 0 0 48.66 17.95 0.15 0.02135 0.02048 751 164 2 8 0 65.580 20.00 17.95 35.20 26.21 26.11 31.4 1001.68 -4227 -6640 -7078 -3478 -7834 -6165 -7691 -2760 -5180 -4074 -3995 -5511 -313 -2563 490 -1600 -1013 -1332 -801 -765 824 -146 -1049 984 -945 -547 -2482 -1228 -1767 -994 999 823 1828 -622 -2739 -3123 -2705 -1169 -418 -86 -791 -189 -957 -695 -854 -483 -914 -874 -628 -470 775 452 799 564 471 650 597 734 745 678 700 1305 1453 1736 684 -46 -420 -542 456 514 647 194 -28 440 198 -54 -406 -774 -442 -303 -346 -706 -1446 -1394 -891 -607 -30 77 545 660 780 493 327 680 618 586 521 743 485 20 -495 -927 -870 -391 -518 -805 -820 -816 -376 -63 153 121 203 82 -212 -88 -108 3 -68 -84 -76 -1 169 232 554 503 389 518 581 578 460 133 -246 -116 -118 -58 -41 -7 14 8 5 -264 -441 -108 -195 -218 -98 -202 -151 -208 -83 -182 -151 -147 -216 -14 -138 30 -106 -71 -99 -63 -63 69 -12 -91 91 -96 -59 -271 -136 -185 -104 114 106 241 -88 -398 -442 -421 -197 -86 -21 -215 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