File name: Pandora21s1_Bremen_20220607_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T111312.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v1d20201116.txt Level 1 file used: Pandora21s1_Bremen_20220607_L1_smca1c1d20201116p1-8.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: 20220607 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]: 305.0633 305.2039 305.3445 305.4851 305.6257 305.7662 305.9068 306.0473 306.1878 306.3283 306.4688 306.6093 306.7497 306.8902 307.0306 307.1711 307.3115 307.4519 307.5923 307.7326 307.8730 308.0134 308.1537 308.2940 308.4343 308.5747 308.7149 308.8552 308.9955 309.1357 309.2760 309.4162 309.5564 309.6966 309.8368 309.9770 310.1172 310.2573 310.3975 310.5376 310.6777 310.8178 310.9579 311.0980 311.2380 311.3781 311.5181 311.6582 311.7982 311.9382 312.0782 312.2182 312.3581 312.4981 312.6380 312.7779 312.9179 313.0578 313.1976 313.3375 313.4774 313.6172 313.7571 313.8969 314.0367 314.1765 314.3163 314.4561 314.5959 314.7356 314.8754 315.0151 315.1548 315.2945 315.4342 315.5739 315.7135 315.8532 315.9928 316.1325 316.2721 316.4117 316.5513 316.6908 316.8304 316.9700 317.1095 317.2490 317.3885 317.5280 317.6675 317.8070 317.9465 318.0859 318.2254 318.3648 318.5042 318.6436 318.7830 318.9224 319.0617 319.2011 319.3404 319.4798 319.6191 319.7584 319.8977 320.0369 320.1762 320.3155 320.4547 320.5939 320.7331 320.8723 321.0115 321.1507 321.2899 321.4290 321.5682 321.7073 321.8464 321.9855 322.1246 322.2637 322.4028 322.5418 322.6808 322.8199 322.9589 323.0979 323.2369 323.3759 323.5148 323.6538 323.7927 323.9317 324.0706 324.2095 324.3484 324.4872 324.6261 324.7650 324.9038 --------------------------------------------------------------------------------------- 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 20220607T083610.1Z 8193.358450 291 1 5.52 2 43.80 117.22 105.48 47.65 0.00 1 0.00 1 0 17 8.945e-03 5.857e-03 7.150e-03 3.751e-03 2.146119e-01 2.010912e-03 2.885554e-03 -6.000000e+00 5.443146e-03 232.94 -2.00 3.88 -2.00 315.93 0.00e+00 -9.885027e-05 1.877445e-04 3.239625e-05 -6.000000e+00 2.143229e-04 278.98 -2.00 20.00 -2.00 315.62 0.00e+00 1.384 0.000 302.00 328.00 3 5.0427e+00 5.2702e-03 1.8781e-02 -6.0000e+00 1.3788e-02 4.0743e-02 5.8278e-03 1.2455e-02 -6.0000e+00 1.4914e-02 -5.0914e-03 3.3484e-03 6.0876e-03 -6.0000e+00 8.7325e-03 8.9272e-04 1.5050e-03 1.6897e-03 -6.0000e+00 3.5956e-03 6.6255e-04 -9.0799e-05 1.1554e-04 2.3188e-05 -6.0000e+00 2.6875e-04 -1.9867e-02 8.1511e-05 12 1 1 12 1 1 99.99 22.30 0.12 -0.01987 -0.02055 6 13 1 5 0 763.470 25.39 20.00 22.30 22.53 29.6 1012.18 -1216 1446 -3672 -1796 -2097 -474 108 2501 -1863 -1208 -526 436 1717 1009 1039 -792 -46 510 2095 -2117 -804 1215 640 1315 -409 1192 -630 711 45 1177 803 1104 1879 -712 -1319 -940 -1192 -556 -801 -445 -1101 -520 -912 -40 -672 -1643 -940 -321 86 865 948 1413 532 675 729 -91 181 821 825 455 1257 730 845 317 245 104 5 685 426 352 -284 104 -189 -89 260 40 490 607 -648 -589 -756 -1176 -2008 -1097 -1131 -774 -310 -156 8 -218 60 286 47 966 694 270 847 1162 22 -468 341 -789 70 286 -880 -399 -222 -142 -10 139 120 17 -57 -138 -297 511 100 28 334 327 -570 47 -544 -82 544 -323 596 937 659 467 200 490 261 286 -207 52 -1 223 -625 -360 -246 -557 81 -256 320 -867 -399 -431 -91 21 527 -445 -300 -131 109 453 295 335 -279 -17 189 789 -845 -323 481 258 544 -178 529 -283 304 19 463 322 464 825 -326 -591 -412 -547 -283 -464 -288 -769 -376 -676 -30 -501 -1229 -691 -230 61 600 672 1040 410 537 593 -75 152 687 685 377 1051 637 773 302 235 97 4 579 369 325 -281 107 -195 -91 254 37 421 497 -537 -516 -715 -1190 -2143 -1206 -1292 -921 -382 -196 10 -273 72 325 51 993 722 296 984 1431 29 -612 431 -961 81 334 -1076 -507 -290 -191 -14 198 175 25 -83 -195 -401 655 127 35 442 451 -812 67 -769 -113 728 -420 748 1156 830 611 271 676 364 406 -303 79 -2 350 -991 -569 -381 -849 121 SS 20220607T111920.3Z 8193.471763 393 1 10.43 2 30.32 178.03 84.82 80.85 0.00 1 0.00 1 0 17 6.595e-03 5.223e-03 2.548e-03 1.685e-03 1.736362e-01 9.110865e-04 2.335620e-03 -6.000000e+00 4.013712e-03 232.94 -2.00 3.88 -2.00 315.04 0.00e+00 1.309009e-04 7.089539e-05 1.955528e-05 -6.000000e+00 1.580217e-04 278.99 -2.00 20.00 -2.00 314.77 0.00e+00 1.158 0.000 302.00 328.00 3 4.5665e+00 2.3713e-03 1.5447e-02 -6.0000e+00 1.0167e-02 2.2691e-02 2.6155e-03 1.0046e-02 -6.0000e+00 1.0997e-02 4.9247e-03 1.4882e-03 4.9050e-03 -6.0000e+00 6.4390e-03 -2.0655e-03 6.4296e-04 1.3584e-03 -6.0000e+00 2.6516e-03 1.4488e-03 9.9258e-06 5.1664e-05 1.9856e-05 -6.0000e+00 1.9813e-04 -2.0586e-02 8.8926e-05 12 1 1 12 1 1 99.90 22.31 0.27 -0.02059 -0.02051 13 13 1 5 0 731.887 25.39 19.99 22.31 23.13 29.9 1016.17 -1000 -2166 -958 -1981 -458 -604 -187 66 773 -468 193 1595 -476 1149 -146 -370 -430 215 692 347 995 -164 1194 145 1076 -41 -281 -265 330 1577 383 1660 1030 30 -886 -29 -976 43 -570 -672 -901 -787 -656 -1045 -559 -643 -388 -644 -606 -168 650 770 460 1019 476 995 273 473 249 765 841 1079 1062 385 -17 -361 289 74 831 227 -260 -63 -409 -2 -182 208 -113 632 133 73 -748 -938 -1401 -1259 -770 -674 -376 -440 20 -379 456 154 301 727 671 572 582 794 -351 -166 -400 -139 2 413 -442 -632 -558 -349 -40 -16 2 -37 -91 -226 -194 221 496 527 248 17 -475 -84 -64 37 369 325 789 750 931 122 618 99 264 185 149 -77 15 37 -516 -131 -518 -293 -464 -309 -709 -313 -638 -131 -168 -53 20 253 -163 66 543 -171 451 -63 -166 -201 102 335 173 501 -81 603 74 572 -23 -155 -139 164 764 190 828 545 16 -469 -15 -529 25 -382 -494 -696 -639 -533 -859 -467 -533 -313 -516 -469 -131 500 624 384 861 416 880 241 426 222 674 756 998 1028 385 -17 -351 261 65 744 214 -265 -67 -438 -2 -184 200 -100 540 114 66 -721 -952 -1500 -1387 -878 -805 -466 -556 26 -472 551 175 322 757 690 617 661 966 -443 -211 -497 -164 3 478 -527 -790 -718 -458 -53 -21 3 -53 -128 -308 -252 275 597 648 317 22 -649 -115 -87 49 474 412 964 892 1133 155 803 130 352 248 206 -110 21 55 -772 -194 -765 -425 -657 SS 20220607T140027.1Z 8193.583647 492 1 49.62 2 42.37 239.83 62.20 113.85 0.00 1 0.00 1 0 17 1.603e-02 6.172e-03 1.169e-02 4.403e-03 2.154581e-01 2.335925e-03 2.868295e-03 -6.000000e+00 9.752840e-03 232.95 -2.00 3.88 -2.00 317.00 0.00e+00 4.761051e-04 2.765698e-04 4.461496e-05 -6.000000e+00 3.839762e-04 279.01 -2.00 20.00 -2.00 316.68 0.00e+00 1.352 0.000 302.00 328.00 3 6.4567e+00 6.1878e-03 1.8593e-02 -6.0000e+00 2.4706e-02 6.6234e-02 6.8633e-03 1.2494e-02 -6.0000e+00 2.6722e-02 -5.3003e-04 4.0590e-03 6.1218e-03 -6.0000e+00 1.5646e-02 -4.2499e-03 1.9178e-03 1.7147e-03 -6.0000e+00 6.4426e-03 1.6340e-04 -1.5009e-04 1.3858e-04 2.2061e-05 -6.0000e+00 4.8146e-04 -2.0186e-02 8.6763e-05 10 0 0 10 0 0 99.98 22.31 0.10 -0.02019 -0.02131 35 7 1 5 0 1417.443 25.39 20.00 22.31 24.43 29.8 1020.78 -4631 -2452 -3632 4529 -6409 4695 -901 9939 1334 1140 921 -388 1551 -4168 -1774 -1574 265 -1181 2692 13 376 2617 632 1324 -845 313 -295 243 -1210 4001 53 1633 1816 -372 -25 -2199 -1088 -1037 -668 -1715 -969 -598 -826 113 -619 408 -76 -1554 -1471 -3 118 266 761 853 1273 533 1092 180 646 531 648 635 1921 1513 -116 -393 -886 -242 372 533 -147 753 47 38 128 -1124 -272 -1534 -294 -574 92 -688 -1402 -401 -1150 -948 -389 -51 371 495 53 1480 156 339 68 552 631 608 403 -171 134 -842 -614 -256 -1307 -690 -866 18 -302 554 545 316 253 253 -531 -26 -409 -450 110 -256 36 471 272 -44 141 371 -133 910 -254 699 -62 69 -333 570 178 -104 281 -18 -2 -160 169 -633 -404 -671 -379 -580 639 -918 573 -119 1299 208 187 152 -66 278 -885 -413 -398 69 -322 729 4 110 746 185 401 -273 103 -98 77 -365 1110 16 503 594 -128 -8 -725 -374 -405 -305 -912 -562 -364 -518 71 -392 255 -47 -946 -875 -2 71 167 502 588 900 388 801 134 471 385 479 495 1579 1315 -103 -333 -701 -182 286 448 -136 725 46 37 116 -953 -208 -1111 -212 -447 79 -649 -1423 -423 -1289 -1128 -486 -66 482 628 64 1628 159 329 67 579 723 758 534 -230 174 -1029 -710 -296 -1607 -894 -1174 25 -439 838 861 509 400 380 -747 -34 -524 -587 151 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