File name: Pandora106s1_Innsbruck_20231220_L2Fit_fout2c9d20221125p1-8.txt File generation date: 20240119T010215.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c9p1-8 Local principal investigator: Martin Tiefengraber Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 106 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora106_OF_v2d20210701.txt Instrument calibration file used: Pandora106s1_CF_v9d20221125.txt Level 1 file used: Pandora106s1_Innsbruck_20231220_L1_smca1c9d20221125p1-8.txt Full location name: Innsbruck Atmospheric Observatory Short location name: Innsbruck Country of location: Austria Location latitude [deg]: 47.2643 Location longitude [deg]: 11.3852 Location altitude [m]: 616 Local noon date: 20231220 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: Modification of session 6 "based on session5: fieldCal for IAO 2022" fieldcal Nov 2022 new refday First and last pixel inside fitting window: 235 377 Nominal wavelengths inside fitting window [nm]: 305.0714 305.2123 305.3533 305.4943 305.6352 305.7761 305.9171 306.0580 306.1989 306.3398 306.4807 306.6215 306.7624 306.9032 307.0441 307.1849 307.3257 307.4666 307.6074 307.7481 307.8889 308.0297 308.1705 308.3112 308.4519 308.5927 308.7334 308.8741 309.0148 309.1555 309.2962 309.4368 309.5775 309.7181 309.8588 309.9994 310.1400 310.2806 310.4212 310.5618 310.7024 310.8430 310.9835 311.1241 311.2646 311.4051 311.5456 311.6861 311.8266 311.9671 312.1076 312.2481 312.3885 312.5290 312.6694 312.8098 312.9502 313.0906 313.2310 313.3714 313.5118 313.6521 313.7925 313.9328 314.0732 314.2135 314.3538 314.4941 314.6344 314.7747 314.9149 315.0552 315.1955 315.3357 315.4759 315.6161 315.7564 315.8966 316.0367 316.1769 316.3171 316.4573 316.5974 316.7375 316.8777 317.0178 317.1579 317.2980 317.4381 317.5782 317.7182 317.8583 317.9983 318.1384 318.2784 318.4184 318.5584 318.6984 318.8384 318.9784 319.1184 319.2583 319.3983 319.5382 319.6781 319.8180 319.9579 320.0978 320.2377 320.3776 320.5174 320.6573 320.7971 320.9370 321.0768 321.2166 321.3564 321.4962 321.6360 321.7758 321.9155 322.0553 322.1950 322.3347 322.4745 322.6142 322.7539 322.8936 323.0332 323.1729 323.3126 323.4522 323.5918 323.7315 323.8711 324.0107 324.1503 324.2899 324.4294 324.5690 324.7086 324.8481 324.9876 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Azimuth motor temperature [°C], 999=no temperature signal Column 99: Zenith motor temperature [°C], 999=no temperature signal Column 100: Humidity in head sensor [%], -9=no humidity signal Column 101: Pressure in head sensor [hPa], -9=no pressure signal Columns 102-244: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 245-387: 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 20231220T102122.8Z 8754.431514 159 1 50.30 2 71.60 167.80 104.14 73.11 0.00 1 0.00 1 0 17 1.914e-01 3.840e-02 3.753e-02 4.788e-03 3.978729e-01 2.787505e-03 5.077401e-03 -6.000000e+00 1.296896e-01 221.41 -2.00 3.66 -2.00 318.84 0.00e+00 8.154817e-03 5.974691e-04 1.627488e-03 -6.000000e+00 5.548502e-03 268.18 -2.00 20.00 -2.00 318.41 0.00e+00 3.130 0.001 302.00 328.00 3 5.6368e+00 7.5145e-03 3.6925e-02 -6.0000e+00 3.1823e-01 1.9109e-01 8.4658e-03 2.7099e-02 -6.0000e+00 3.4553e-01 -2.0885e-01 5.4734e-03 1.0612e-02 -6.0000e+00 2.0519e-01 1.1101e-01 2.6888e-03 8.0929e-03 -6.0000e+00 8.3236e-02 6.0692e-05 -9.0640e-04 1.9987e-04 1.1585e-04 -6.0000e+00 8.1255e-03 4.5610e-02 0.0000e+00 12 9 8 11 32 0 99.99 17.48 -0.15 0.04561 0.03880 21 4 1 5 0 2394.810 21.69 15.00 17.48 9.88 40.30 38.30 44.8 919.12 -939 -116972 38552 23877 -40340 -20793 42732 95282 89857 -4578 1727 -21569 39415 20911 14639 10403 27209 12157 41697 43900 -6359 14688 1752 -11252 7685 7746 11889 15975 -5477 2859 10875 -4352 6974 32229 24034 7865 31999 6575 1468 393 10541 221 -6596 3883 4622 6326 628 5002 9666 14350 636 5129 3747 4238 -3090 4210 662 -3751 4680 -5621 -2459 4591 -421 5059 1592 2645 824 4698 1190 -2439 -4400 -538 1650 -2208 -2803 -2391 2319 -428 -3441 -12087 -1407 -2083 -3311 807 -2391 -4637 147 486 -2804 19 839 2732 -744 1301 -1005 3470 384 -1849 65 1926 -216 2012 -488 634 119 2686 246 1232 3846 1522 -15915 505 748 1238 2530 111 1185 501 2349 656 848 2254 769 1071 -1513 3015 -548 4432 -612 1754 528 1311 45 865 218 -309 -1393 -367 -583 -632 -1001 -1968 900000 -53 -21044 1581 1091 -3323 -1366 1496 2190 2259 -285 108 -1899 2195 1646 1411 1166 2786 1528 4047 4246 -1020 1905 259 -1914 1089 1095 1598 2046 -886 450 1715 -866 1309 4804 3935 1576 5496 1640 406 122 3179 78 -2573 1394 1669 2264 240 1847 3484 5141 276 2258 1760 2058 -1653 2116 345 -2035 2342 -3200 -1428 2655 -255 3211 985 1701 537 3034 793 -1804 -3483 -416 1223 -1617 -1927 -1634 1463 -284 -2378 -10091 -1170 -1904 -3099 771 -2500 -5202 162 540 -3159 20 826 2661 -735 1298 -1040 3778 472 -2343 83 2508 -275 2395 -586 766 151 3497 328 1731 5601 2393 -27686 786 1194 1884 3646 161 1713 752 3582 1039 1340 3446 1156 1546 -2158 4245 -802 6398 -930 2763 887 2283 79 1560 411 -605 -2662 -730 -1147 -1207 -1859 -3622 900000 SS 20231220T104323.1Z 8754.446795 168 1 49.95 2 70.98 173.08 100.59 77.15 0.00 1 0.00 1 0 25 2.791e-02 7.002e-03 3.541e-03 5.620e-04 3.968049e-01 3.273699e-04 4.976249e-03 -6.000000e+00 1.891328e-02 221.41 -2.00 3.66 -2.00 318.47 0.00e+00 5.050498e-04 6.571523e-05 4.200441e-04 -6.000000e+00 8.091756e-04 268.18 -2.00 20.00 -2.00 318.03 0.00e+00 3.034 0.001 302.00 328.00 3 1.8339e+00 8.7139e-04 3.4799e-02 -6.0000e+00 4.6409e-02 7.6777e-02 9.8274e-04 2.0966e-02 -6.0000e+00 5.0391e-02 -4.3146e-02 6.5536e-04 1.0530e-02 -6.0000e+00 2.9924e-02 1.1022e-02 3.2872e-04 3.0916e-03 -6.0000e+00 1.2138e-02 3.1189e-03 -9.5079e-04 2.3203e-05 5.6306e-05 -6.0000e+00 1.1850e-03 4.5862e-02 0.0000e+00 11 8 0 10 0 0 99.99 17.49 0.13 0.04586 0.03872 762 154 1 5 0 65.540 21.69 15.00 17.49 10.74 41.10 39.10 44.6 922.41 -9785 -16663 -9079 -9485 -11953 -7344 -8267 -6765 -5444 -5857 -4648 -3963 -1360 -2864 -1405 -1882 -190 229 501 1456 571 1509 -316 -490 -947 -852 -1054 188 919 285 406 -918 80 -209 494 1464 1457 251 -902 -566 -744 -646 -836 -712 -642 -308 -65 63 1026 1183 1005 1495 697 849 323 522 555 851 1381 1467 1523 644 -371 -494 -203 632 1248 1215 444 -110 -984 -1117 -930 -652 -202 691 1436 1025 770 -679 -863 -962 -938 -655 -789 -900 -930 -1109 -871 -296 341 1315 1612 1625 1380 707 -443 -916 -1020 -360 298 952 653 26 -90 13 57 197 -128 -652 -1102 -618 -198 571 1183 1240 865 43 -410 -575 -666 -457 -387 -152 499 1102 1075 667 176 83 78 518 236 81 24 -262 -539 -410 -536 -199 96 335 900000 -452 -884 -454 -466 -588 -349 -420 -367 -316 -365 -309 -292 -112 -276 -152 -226 -22 28 64 191 77 208 -46 -75 -152 -139 -172 30 146 47 72 -179 16 -44 106 329 364 73 -305 -197 -282 -258 -346 -299 -271 -130 -27 27 442 532 482 762 380 449 178 294 315 482 780 845 917 416 -257 -355 -146 444 870 877 344 -86 -815 -944 -771 -514 -159 506 1005 735 595 -546 -771 -877 -922 -685 -876 -984 -1051 -1265 -973 -336 364 1322 1583 1642 1501 796 -550 -1219 -1308 -479 377 1148 778 31 -115 18 77 281 -195 -993 -1740 -974 -302 878 1735 1782 1259 64 -609 -875 -1014 -682 -593 -224 703 1508 1475 953 268 128 126 870 393 142 44 -496 -989 -755 -1026 -369 172 592 900000 SS 20231220T104832.3Z 8754.450374 172 1 49.40 2 70.89 174.33 99.74 78.08 0.00 1 0.00 1 0 25 1.423e-01 2.451e-02 2.927e-02 4.340e-03 3.818171e-01 2.527480e-03 4.833722e-03 -6.000000e+00 9.629537e-02 221.41 -2.00 3.66 -2.00 318.82 0.00e+00 6.230106e-03 5.392626e-04 5.018303e-04 -6.000000e+00 4.122145e-03 268.18 -2.00 20.00 -2.00 318.38 0.00e+00 3.019 0.001 302.00 328.00 3 5.4577e+00 6.8236e-03 3.4596e-02 -6.0000e+00 2.3628e-01 1.5943e-01 7.6989e-03 2.2147e-02 -6.0000e+00 2.5663e-01 -1.5164e-01 5.0053e-03 1.0447e-02 -6.0000e+00 1.5240e-01 7.6585e-02 2.4637e-03 5.9679e-03 -6.0000e+00 6.1755e-02 8.2845e-05 -1.8189e-03 1.8293e-04 9.7074e-05 -6.0000e+00 6.0391e-03 5.2342e-02 0.0000e+00 12 8 8 10 0 0 99.98 17.50 -0.14 0.05234 0.03867 41 8 1 5 0 1204.820 21.69 15.00 17.50 10.94 41.60 40.10 44.7 923.17 6190 -110268 3869 2657 -28644 -31563 14874 62145 53877 2369 -9541 -19751 28379 7637 7130 1946 23133 10974 32723 21318 -4146 15227 -3633 -3820 5490 4944 228 5378 -5856 -5151 8389 248 5424 21218 20976 5984 17392 8334 -14261 2108 7497 -245 -2875 4258 2632 3358 3790 4683 6236 10361 1893 4766 2099 914 -2690 5483 1153 -1270 3291 -3065 -1226 3059 953 2464 3089 2138 1923 3690 712 -1553 -4239 -20 753 -1051 -3352 -1301 2187 -1234 -2925 -8857 -1360 -2944 -2138 935 -2568 -3508 -893 -77 -3539 137 678 1972 80 2156 -518 1552 1472 -1926 -1085 846 37 792 -542 357 -1286 1994 -406 820 2498 -45 -941 -615 -129 -597 1262 -219 -222 112 708 278 -246 1062 164 644 -677 1858 227 3086 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