File name: Pandora21s1_Bremen_20200908_L2Fit_fout2c14d20191026p1-8.txt File generation date: 20250507T105244.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c14p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v14d20191026.txt Level 1 file used: Pandora21s1_Bremen_20200908_L1_smca1c14d20191026p1-8.txt Full location name: Bremen University Short location name: Bremen Country of location: Germany Location latitude [deg]: 53.0813 Location longitude [deg]: 8.8126 Location altitude [m]: 50 Local noon date: 20200908 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, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 286 428 Nominal wavelengths inside fitting window [nm]: 305.1120 305.2523 305.3926 305.5329 305.6731 305.8134 305.9537 306.0939 306.2341 306.3744 306.5146 306.6548 306.7950 306.9352 307.0753 307.2155 307.3557 307.4958 307.6359 307.7761 307.9162 308.0563 308.1964 308.3364 308.4765 308.6166 308.7566 308.8966 309.0367 309.1767 309.3167 309.4567 309.5967 309.7366 309.8766 310.0166 310.1565 310.2964 310.4363 310.5763 310.7162 310.8560 310.9959 311.1358 311.2756 311.4155 311.5553 311.6952 311.8350 311.9748 312.1146 312.2543 312.3941 312.5339 312.6736 312.8134 312.9531 313.0928 313.2325 313.3722 313.5119 313.6516 313.7913 313.9309 314.0706 314.2102 314.3498 314.4894 314.6290 314.7686 314.9082 315.0478 315.1873 315.3269 315.4664 315.6059 315.7455 315.8850 316.0245 316.1639 316.3034 316.4429 316.5823 316.7218 316.8612 317.0006 317.1400 317.2794 317.4188 317.5582 317.6976 317.8369 317.9763 318.1156 318.2549 318.3942 318.5335 318.6728 318.8121 318.9514 319.0906 319.2299 319.3691 319.5083 319.6475 319.7867 319.9259 320.0651 320.2043 320.3435 320.4826 320.6217 320.7609 320.9000 321.0391 321.1782 321.3173 321.4563 321.5954 321.7345 321.8735 322.0125 322.1515 322.2906 322.4296 322.5685 322.7075 322.8465 322.9854 323.1244 323.2633 323.4022 323.5411 323.6800 323.8189 323.9578 324.0967 324.2355 324.3744 324.5132 324.6520 324.7908 324.9296 --------------------------------------------------------------------------------------- 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: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20200908T065351.9Z 7556.287406 267 1 49.84 2 72.01 105.36 54.02 244.82 0.00 1 0.00 1 0 17 1.926e-01 1.321e-02 1.447e-01 9.893e-03 3.904301e-01 5.201456e-03 5.056736e-03 -6.000000e+00 1.150052e-01 229.47 -2.00 3.88 -2.00 319.44 0.00e+00 -1.137199e-03 1.199533e-03 1.817526e-04 -6.000000e+00 4.609899e-03 280.23 -2.00 20.00 -2.00 319.11 0.00e+00 3.194 0.001 302.00 328.00 3 5.7610e+00 1.4306e-02 3.8920e-02 -6.0000e+00 2.8880e-01 1.3212e-01 1.6338e-02 2.2496e-02 -6.0000e+00 3.1391e-01 -1.8485e-02 1.2817e-02 1.1335e-02 -6.0000e+00 1.8427e-01 -6.4545e-03 6.8181e-03 3.3465e-03 -6.0000e+00 7.5926e-02 4.2140e-05 -6.2678e-04 3.2098e-04 4.2355e-05 -6.0000e+00 5.7961e-03 -1.7792e-03 0.0000e+00 12 8 8 10 0 0 99.99 22.30 0.40 -0.00178 -0.00649 30 6 1 5 0 1661.004 25.28 20.00 22.30 22.34 20.1 1006.42 -46739 147912 11675 110475 -8523 38480 -11307 -395 13433 -34272 53664 -17235 51628 -906 45376 22543 -12592 -17406 -5475 6083 -16473 13918 3815 3653 -11723 8637 -10717 8384 1775 11825 11663 -9558 11291 1938 10603 -13065 1680 3757 -1385 5099 926 4074 -4151 -2250 -5286 1580 -2893 -1814 -1830 1248 3793 -3206 5810 -1445 3902 -149 1261 5 95 -377 -281 6951 -595 1305 -3606 3118 599 1139 1403 1488 -1139 -2932 2322 -1495 798 -3133 208 -2076 1595 3117 264 1771 -3523 389 -2828 564 529 -62 -123 461 1337 445 123 15 2482 -1825 277 -1169 1428 -959 38 -296 -608 123 -2040 206 -1469 1496 -748 1329 -85 -58 481 -1140 1036 -102 1956 -242 -384 -1070 -791 -411 -263 1316 85 727 -504 2718 -593 427 -1042 1117 401 -258 -315 -680 1300 -868 350 298 293 -889 -287 -2086 1427 345 1359 -270 826 -400 -14 471 -1900 1453 -921 1736 -55 2096 1391 -1130 -1724 -510 529 -1792 1168 366 376 -1480 938 -1376 868 189 1175 1260 -1384 1458 279 1370 -2130 263 679 -312 1245 258 1158 -1314 -707 -1714 480 -913 -564 -575 394 1250 -1220 2171 -613 1639 -67 572 2 43 -170 -131 3244 -325 744 -2173 1684 318 604 801 946 -805 -2195 1644 -1053 511 -1896 113 -1126 890 1927 189 1383 -3109 350 -2789 573 565 -68 -135 487 1312 408 107 13 2214 -1877 312 -1469 1854 -1269 47 -341 -667 136 -2444 256 -1939 2016 -1093 2040 -140 -98 797 -1825 1522 -145 2690 -351 -589 -1734 -1300 -665 -412 1970 124 1003 -679 3577 -857 661 -1737 1897 706 -476 -614 -1392 2689 -1865 746 624 591 -1741 -547 SS 20200908T112033.4Z 7556.472609 442 1 2.77 2 47.67 179.42 91.09 298.57 0.00 1 0.00 1 0 25 8.071e-03 6.029e-03 8.831e-04 6.143e-04 1.735050e-01 3.271239e-04 2.359784e-03 -6.000000e+00 4.819534e-03 229.45 -2.00 3.88 -2.00 314.90 0.00e+00 1.763935e-04 2.502943e-05 1.745623e-05 -6.000000e+00 1.931425e-04 280.22 -2.00 20.00 -2.00 314.62 0.00e+00 1.482 0.000 302.00 328.00 3 1.3586e+00 8.4355e-04 1.7770e-02 -6.0000e+00 1.2102e-02 3.9954e-03 9.3432e-04 9.9429e-03 -6.0000e+00 1.3154e-02 3.2926e-03 5.3225e-04 4.8798e-03 -6.0000e+00 7.7215e-03 -2.1470e-03 2.2854e-04 1.3638e-03 -6.0000e+00 3.1826e-03 2.6801e-02 -3.5217e-04 1.8858e-05 2.0198e-05 -6.0000e+00 2.4284e-04 -3.5162e-03 0.0000e+00 12 1 1 12 1 1 99.85 22.47 0.23 -0.00352 -0.00616 95 356 1 5 0 26.195 25.39 20.00 22.47 25.20 20.0 1019.82 -1019 -1713 -3034 -3179 -1838 81 967 1526 490 -582 -200 1003 1047 748 356 -210 104 542 668 364 675 1114 925 761 342 -283 -1008 -454 701 1381 1777 1642 407 -929 -623 -143 317 489 64 -805 -890 -954 -1102 -1116 -1049 -1000 -1067 -989 -311 564 720 1007 847 619 613 748 466 364 683 907 1151 1250 954 104 -350 -54 -49 721 867 236 -142 -363 -363 -531 -246 -66 170 568 411 -155 -588 -1225 -1293 -1021 -1033 -757 -488 -376 -321 -151 231 313 826 1073 829 679 673 102 -378 -465 -233 -117 543 95 -697 -484 -612 -327 -104 -88 -181 -158 -56 123 447 658 492 337 39 -468 -498 -100 -101 371 616 638 1168 1163 500 342 129 148 93 322 -286 -326 -41 -257 -422 -149 -301 -298 -251 -353 -626 -1103 -1064 -552 25 314 510 178 -219 -74 379 406 324 161 -101 51 273 344 182 360 590 472 406 191 -162 -566 -238 361 689 913 893 222 -510 -344 -79 179 305 45 -614 -700 -781 -921 -936 -876 -825 -856 -765 -243 437 579 814 720 524 531 658 415 323 597 794 1039 1151 941 103 -341 -50 -44 628 798 232 -146 -374 -375 -552 -248 -63 153 482 359 -143 -580 -1274 -1377 -1143 -1188 -895 -587 -466 -397 -187 275 351 876 1089 873 747 784 126 -475 -579 -283 -137 607 110 -839 -596 -791 -424 -141 -121 -250 -219 -77 162 560 799 590 419 51 -626 -668 -138 -137 479 781 796 1431 1410 613 429 169 199 122 438 -398 -462 -60 -385 -619 -222 -437 -433 -358 SS 20200908T112511.9Z 7556.475833 445 1 49.89 2 47.67 180.98 91.67 299.48 0.00 1 0.00 1 0 17 7.798e-03 5.066e-03 1.291e-03 6.304e-04 1.740652e-01 3.295771e-04 2.351286e-03 -6.000000e+00 4.656543e-03 229.45 -2.00 3.88 -2.00 316.35 0.00e+00 1.617725e-04 3.407307e-05 2.863013e-05 -6.000000e+00 1.866050e-04 280.21 -2.00 20.00 -2.00 316.02 0.00e+00 1.483 0.000 302.00 328.00 3 3.5417e+00 8.6105e-04 1.7805e-02 -6.0000e+00 1.1693e-02 1.3465e-02 9.5719e-04 9.9984e-03 -6.0000e+00 1.2709e-02 5.6135e-03 5.5523e-04 4.9171e-03 -6.0000e+00 7.4603e-03 -3.9083e-03 2.5392e-04 1.3856e-03 -6.0000e+00 3.0750e-03 3.0029e-03 -2.2132e-04 1.9796e-05 1.8985e-05 -6.0000e+00 2.3462e-04 -3.6878e-03 0.0000e+00 10 0 0 10 0 0 99.99 22.48 0.14 -0.00369 -0.00535 575 113 1 5 0 85.852 25.47 20.00 22.48 25.26 20.1 1021.17 -798 -1641 -3305 -3494 -1423 470 992 1420 -98 -452 -720 861 735 755 146 -400 146 276 391 199 503 956 943 637 362 -319 -1029 -243 250 1251 1553 1859 305 -1025 -551 -145 603 613 278 -699 -729 -996 -974 -971 -799 -961 -1091 -869 -606 567 619 914 732 642 538 694 541 315 779 978 1339 1292 1025 156 -353 -146 -133 698 862 476 -165 -122 -324 -356 -249 -119 143 526 471 -174 -618 -1202 -1243 -968 -748 -643 -286 -213 -255 -38 196 278 742 975 770 619 665 107 -231 -308 -264 -257 336 43 -539 -580 -586 -385 66 58 -18 -44 -82 71 253 547 330 339 15 -418 -415 -242 -78 263 515 503 1009 926 458 257 10 38 104 324 -184 -245 56 -89 -312 -64 -269 -267 -172 -161 -349 -701 -683 -263 83 186 293 -22 -105 -166 202 189 216 44 -128 48 92 134 70 177 335 338 238 142 -128 -405 -94 90 438 560 707 123 -418 -213 -56 253 299 152 -436 -490 -698 -696 -697 -570 -678 -749 -575 -388 359 407 633 533 486 417 546 431 250 609 764 1078 1109 942 142 -334 -127 -107 543 709 435 -156 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