File name: Pandora21s1_Bremen_20230201_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T133029.8Z 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_20230201_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: 20230201 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 20230201T130429.3Z 8432.544783 402 1 36.14 2 72.59 201.59 80.22 58.58 0.00 1 0.00 1 0 17 3.753e-01 1.046e-02 1.945e-01 6.630e-03 6.109491e-01 3.547160e-03 7.852252e-03 -6.000000e+00 2.198948e-01 222.56 -2.00 3.88 -2.00 320.43 0.00e+00 2.651945e-03 1.135146e-03 4.673904e-04 -6.000000e+00 9.301083e-03 265.80 -2.00 20.00 -2.00 320.14 0.00e+00 3.295 0.001 302.00 328.00 3 4.6517e+00 1.0033e-02 4.7626e-02 -6.0000e+00 5.4457e-01 2.0255e-01 1.2500e-02 3.4769e-02 -6.0000e+00 5.9392e-01 -9.9351e-02 1.3002e-02 1.8857e-02 -6.0000e+00 3.4963e-01 2.9050e-02 6.8287e-03 6.0965e-03 -6.0000e+00 1.4818e-01 8.3251e-05 -2.1862e-03 1.9945e-04 7.8478e-05 -6.0000e+00 1.1313e-02 -2.7599e-02 -2.0285e-04 12 9 9 12 1 1 99.98 22.13 0.35 -0.02760 -0.04403 21 6 1 5 0 1634.519 25.28 20.00 22.13 9.63 30.9 999.75 900000 -63215 -29194 -75971 -58951 -53730 -112948 314273 -109921 900000 -85505 90473 -86469 -12883 31119 -29023 113349 -13721 54189 2014 9649 -59681 18631 -2791 -7056 -11205 -13027 -7910 -20396 20087 -18603 600 -9673 22705 11180 2906 -4789 -2385 8373 -1605 13546 -7939 14178 -2944 3171 7574 4345 3862 145 1420 4 4385 -185 5059 2675 634 -1035 1495 2283 -761 4011 -662 4366 -1684 5474 -2649 1530 2615 1851 -673 350 948 -1725 317 -3971 504 -364 383 -2303 -1596 -577 -1514 115 -1344 1619 -2949 -419 -358 1429 484 -840 1727 -451 2767 -785 618 627 124 914 -1112 -244 -934 777 -293 349 -1087 136 -1179 -586 76 -790 648 -923 147 -138 1039 30 359 305 -168 662 -348 638 -635 976 -193 549 1301 481 -354 -206 -231 592 437 -228 -167 -351 317 -528 450 -530 -640 590 900000 -792 -293 -1145 -728 -616 -2258 2031 -2611 900000 -1877 585 -2505 -242 486 -899 1142 -457 1071 66 304 -3516 562 -108 -303 -526 -635 -364 -1040 744 -1095 35 -697 1315 720 199 -372 -208 786 -195 1614 -1252 1911 -480 496 1155 696 635 26 262 1 938 -45 1269 727 183 -312 441 656 -221 1126 -208 1450 -657 2128 -1116 607 1034 786 -327 185 529 -992 172 -2085 231 -155 158 -1038 -813 -336 -1009 83 -1047 1296 -2604 -379 -334 1318 439 -733 1377 -348 2058 -643 560 644 144 1148 -1463 -309 -1097 826 -304 371 -1235 160 -1477 -780 109 -1249 1074 -1578 244 -220 1563 44 541 478 -275 1089 -567 995 -969 1415 -273 745 1750 693 -566 -359 -427 1134 874 -481 -368 -797 728 -1221 1015 -1157 -1329 1162 SS 20230201T130918.9Z 8432.548135 405 1 48.56 2 72.86 202.76 79.62 59.44 0.00 1 0.00 1 0 17 5.909e-01 9.380e-03 2.126e-01 4.253e-03 6.236234e-01 2.302429e-03 7.886198e-03 -6.000000e+00 3.465265e-01 222.56 -2.00 3.88 -2.00 320.72 0.00e+00 2.364006e-03 7.905068e-04 5.599597e-04 -6.000000e+00 1.441669e-02 265.80 -2.00 20.00 -2.00 320.43 0.00e+00 3.344 0.001 302.00 328.00 3 3.2657e+00 6.6456e-03 4.8580e-02 -6.0000e+00 8.5688e-01 5.5841e-02 8.5421e-03 3.5759e-02 -6.0000e+00 9.3381e-01 3.1411e-02 9.3369e-03 1.9805e-02 -6.0000e+00 5.5123e-01 -2.2509e-02 4.8344e-03 6.5692e-03 -6.0000e+00 2.3524e-01 3.2857e-04 -1.1088e-03 1.3093e-04 8.5188e-05 -6.0000e+00 1.7823e-02 -3.0135e-02 2.1438e-05 12 8 8 10 0 0 99.99 22.13 0.18 -0.03013 -0.03847 485 95 1 5 0 100.103 25.28 19.99 22.13 9.94 31.0 1002.29 900000 -124102 900000 30075 -19399 513843 -164319 56066 -113253 174344 -119193 288631 -13616 45058 20654 -5541 -731 -13140 51440 -1495 20386 -32170 59143 -17642 28305 12027 -1752 20674 -1357 23495 -24271 34575 3647 18010 3412 6854 5874 9846 22430 -4002 10202 -8303 9930 -4559 4742 -6437 9209 4839 -1595 3090 -6624 7227 -1490 4106 -3629 2448 411 -393 750 -4191 3039 -1295 3925 -1935 3532 -195 1524 3225 -290 267 -2152 1361 -1727 1374 -906 2338 -1288 642 396 -535 46 -1654 658 -1880 -711 -1962 -653 -274 -191 -506 385 1793 361 2057 355 1485 824 782 -558 -374 -126 -414 1437 -40 70 -777 94 -1302 140 -6 -513 -144 -595 99 -494 918 577 751 628 -267 -504 -114 199 -420 248 -640 1345 671 866 108 -272 -111 -398 331 -243 -45 -222 654 -614 340 -206 -348 319 900000 -1905 900000 143 -136 2130 -3778 237 -2144 723 -2726 1197 -177 449 303 -116 -17 -359 916 -42 503 -1212 1136 -652 786 400 -66 658 -51 762 -1275 1317 200 950 204 397 361 664 1602 -414 1055 -1085 1171 -629 615 -938 1201 672 -244 479 -1209 1286 -313 886 -891 595 105 -102 190 -1091 752 -356 1140 -658 1223 -70 534 1124 -112 114 -1039 674 -888 663 -416 953 -502 241 159 -246 25 -1010 434 -1358 -538 -1591 -550 -238 -167 -432 310 1334 259 1444 271 1259 803 862 -683 -473 -154 -466 1454 -39 71 -846 106 -1579 180 -9 -797 -238 -1010 163 -785 1370 845 1118 978 -437 -836 -185 310 -636 360 -899 1793 899 1239 172 -479 -209 -788 682 -531 -103 -526 1568 -1492 804 -469 -750 653 SS 20230201T131423.6Z 8432.551662 408 1 17.41 2 73.16 203.99 78.98 60.34 0.00 1 0.00 1 0 25 3.652e-01 6.181e-03 1.941e-01 4.262e-03 6.294799e-01 2.248357e-03 8.040712e-03 -6.000000e+00 2.140982e-01 222.56 -2.00 3.88 -2.00 320.26 0.00e+00 2.167191e-03 7.054535e-04 4.752363e-04 -6.000000e+00 8.755759e-03 265.80 -2.00 20.00 -2.00 319.99 0.00e+00 3.400 0.001 302.00 328.00 3 3.6052e+00 6.3167e-03 4.9004e-02 -6.0000e+00 5.2942e-01 1.5626e-01 7.8501e-03 3.5674e-02 -6.0000e+00 5.7669e-01 -6.4204e-02 8.2120e-03 1.9320e-02 -6.0000e+00 3.4033e-01 1.1531e-02 4.3310e-03 6.2295e-03 -6.0000e+00 1.4332e-01 2.1496e-04 -1.0431e-03 1.2419e-04 7.7434e-05 -6.0000e+00 1.0942e-02 -2.9748e-02 5.6576e-07 12 1 1 12 1 1 99.96 22.13 0.13 -0.02975 -0.03759 19 11 1 5 0 860.176 25.28 20.00 22.13 10.40 30.9 1004.00 -51266 44697 2658 72370 -77081 392181 -275 -20389 -42806 -39770 -10495 -14869 -15625 -41555 15234 -23433 -15614 -31303 833 -17954 -16802 13273 -19548 8543 -23217 9703 -21422 16613 -15773 3210 11223 -7490 7012 -12652 -864 -4886 7330 -7644 3276 -4757 -853 -992 -5200 868 -4623 2211 -5045 4593 -3015 3136 1641 2831 3352 652 3033 1186 2241 -266 706 2787 2591 1226 921 457 -874 2154 -187 1044 673 1249 335 223 -449 -16 986 -1207 1635 -1895 1946 -1152 272 -214 -1647 -1405 -1323 -264 -538 -32 -261 1252 292 1230 -26 75 563 -287 769 280 78 -563 -139 -314 -395 241 -1101 -358 -710 -226 -131 157 -311 -90 163 -90 76 6 1027 -95 318 -504 -42 -115 -23 -59 -85 114 793 1272 -100 212 -39 377 246 208 -46 -380 99 -262 190 -275 80 -224 -171 -437 195 18 301 -988 1630 -2 -184 -517 -508 -112 -181 -227 -926 255 -643 -452 -1141 25 -662 -634 391 -790 288 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