File name: Pandora21s1_Bremen_20210916_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T090155.9Z 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_20210916_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: 20210916 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 20210916T074508.3Z 7929.323012 139 1 15.32 2 66.99 119.09 152.20 4.22 0.00 1 0.00 1 0 25 2.163e-02 5.866e-03 2.236e-02 3.979e-03 3.205046e-01 2.070005e-03 4.280888e-03 -6.000000e+00 1.292177e-02 228.57 -2.00 3.88 -2.00 318.36 0.00e+00 2.265693e-04 3.612241e-04 1.072458e-04 -6.000000e+00 5.182079e-04 279.47 -2.00 20.00 -2.00 318.04 0.00e+00 2.538 0.000 302.00 328.00 3 3.9462e+00 5.5480e-03 3.1278e-02 -6.0000e+00 3.2383e-02 3.3717e-02 6.2226e-03 1.8462e-02 -6.0000e+00 3.5176e-02 8.1508e-03 4.2094e-03 9.2110e-03 -6.0000e+00 2.0666e-02 -9.1133e-03 2.1936e-03 2.6654e-03 -6.0000e+00 8.5575e-03 5.5408e-04 -7.0105e-04 1.2555e-04 3.3163e-05 -6.0000e+00 6.4965e-04 -2.4798e-03 -4.9041e-06 12 1 1 12 1 1 99.98 22.26 0.25 -0.00248 -0.00775 16 11 2 5 0 890.373 25.39 20.00 22.26 22.82 27.0 998.72 3936 -3420 4075 -9470 11215 -8401 -3032 -8017 -1032 4514 -3103 1877 -2809 -2728 -3848 2420 -3685 -2222 808 -4188 -2596 887 1996 -3615 3076 -1967 2692 1145 -3611 423 -858 805 -283 2141 -1665 -1104 750 -24 786 -1699 -885 -1177 -711 -1245 693 -931 -185 -375 -403 1162 1081 1446 937 65 75 -4 1602 1063 1365 863 1688 821 1505 109 915 1101 -762 1011 810 392 -361 -746 -923 110 -599 334 371 781 -524 -958 -697 -1406 -1121 -1148 -1091 -1007 -302 42 -51 367 642 905 189 1210 664 528 684 130 -376 -70 -250 -598 -189 110 -527 -303 -700 -655 396 222 27 -456 194 199 208 459 -106 558 -166 -404 -453 -338 -366 -482 98 197 729 1110 1058 529 318 699 158 444 118 97 -160 45 -531 -344 -332 -303 -119 201 -205 236 -597 546 -474 -171 -527 -70 309 -233 141 -247 -276 -450 295 -508 -318 118 -663 -415 139 316 -637 540 -377 495 206 -651 73 -159 160 -62 471 -370 -242 173 -6 246 -627 -356 -502 -312 -557 306 -418 -82 -165 -176 510 497 708 489 36 43 -2 947 633 802 507 1007 523 1023 79 672 778 -520 667 561 299 -299 -647 -808 93 -483 247 254 512 -358 -719 -578 -1278 -1083 -1163 -1161 -1129 -352 50 -61 431 717 945 187 1154 657 564 795 165 -503 -94 -325 -734 -221 129 -650 -392 -942 -914 571 336 43 -741 311 307 304 640 -146 782 -244 -622 -715 -532 -566 -727 143 276 985 1485 1471 780 493 1112 257 741 206 176 -296 85 -1010 -649 -610 -542 -208 SS 20210916T080522.1Z 7929.337062 148 1 49.26 2 64.40 123.86 151.73 13.41 0.00 1 0.00 1 0 17 5.731e-02 1.199e-02 4.374e-02 8.500e-03 3.063982e-01 4.422851e-03 4.060943e-03 -6.000000e+00 3.422691e-02 228.56 -2.00 3.88 -2.00 318.32 0.00e+00 4.706939e-05 7.497239e-04 9.884406e-05 -6.000000e+00 1.372972e-03 279.47 -2.00 20.00 -2.00 318.00 0.00e+00 2.300 0.000 302.00 328.00 3 6.3627e+00 1.1835e-02 2.8877e-02 -6.0000e+00 8.5775e-02 1.3337e-01 1.3276e-02 1.7527e-02 -6.0000e+00 9.3180e-02 -1.8368e-02 8.7905e-03 8.7398e-03 -6.0000e+00 5.4743e-02 2.6648e-03 4.5362e-03 2.5327e-03 -6.0000e+00 2.2664e-02 6.0618e-05 -9.5116e-04 2.6919e-04 3.1503e-05 -6.0000e+00 1.7213e-03 -2.3965e-03 -7.0212e-05 12 8 8 10 0 0 99.97 22.25 0.82 -0.00240 -0.00954 15 3 1 5 0 3283.486 25.39 20.00 22.25 23.57 27.3 1002.28 -5358 4539 10060 -11993 22406 -17296 -9305 44520 -2793 -14328 5062 2556 -283 -4745 6576 -5634 -1297 -5315 9515 -6458 9421 -2029 11439 -394 -2260 6867 -3480 10287 -2129 3329 -5201 8083 -2728 -484 -551 388 -2838 -5442 1863 -3582 1885 -441 1072 -288 1556 -298 -1643 -2164 -4494 -375 -3890 3550 -1223 595 1437 1449 -116 -370 -1322 -3049 4422 1846 4820 -255 1169 -229 -2453 2340 -991 1456 291 2621 54 533 -354 453 1236 -3245 -1412 -3168 -842 -1295 24 -1997 -681 449 1004 441 -26 1519 967 982 -1734 1337 -2825 -1145 -467 252 1367 1119 220 -1205 42 -968 -91 -1338 -827 -245 586 1037 -317 1687 258 -806 -993 -703 -1821 -767 -150 -874 209 36 717 -135 -511 1174 1315 14 -1409 775 548 1347 -197 656 280 275 833 530 110 -383 -324 -864 -1117 -358 302 652 -912 1146 -1232 -646 2086 -223 -1341 402 217 -27 -548 777 -824 -193 -862 1394 -1140 1460 -352 1785 -73 -448 1294 -722 1794 -398 584 -1041 1550 -626 -112 -124 85 -689 -1565 592 -1388 764 -193 477 -131 698 -136 -751 -976 -2056 -167 -1875 1703 -653 329 816 844 -70 -223 -793 -1847 2552 1161 3178 -187 859 -162 -1672 1488 -683 1085 239 2210 47 447 -281 326 806 -2101 -926 -2330 -678 -1154 23 -2027 -723 502 1176 535 -32 1787 1076 1009 -1693 1225 -2789 -1211 -543 319 1822 1505 286 -1471 48 -1118 -110 -1737 -1117 -343 855 1597 -521 2788 424 -1274 -1467 -975 -2501 -1069 -219 -1357 331 57 1099 -202 -734 1587 1702 19 -1929 1111 832 2099 -319 1086 487 501 1559 1015 213 -735 -602 -1557 -1963 SS 20210916T081050.3Z 7929.340860 151 1 16.53 2 63.72 125.18 151.52 15.85 0.00 1 0.00 1 0 25 1.401e-02 5.787e-03 8.728e-03 2.252e-03 2.870251e-01 1.172626e-03 3.844959e-03 -6.000000e+00 8.367281e-03 228.56 -2.00 3.88 -2.00 317.70 0.00e+00 -8.191280e-05 1.707585e-04 7.812758e-05 -6.000000e+00 3.355306e-04 279.47 -2.00 20.00 -2.00 317.38 0.00e+00 2.246 0.000 302.00 328.00 3 4.0877e+00 3.1093e-03 2.7765e-02 -6.0000e+00 2.0969e-02 3.3588e-02 3.4719e-03 1.6457e-02 -6.0000e+00 2.2777e-02 3.7285e-03 2.1817e-03 8.1702e-03 -6.0000e+00 1.3382e-02 -6.2278e-03 1.0977e-03 2.3416e-03 -6.0000e+00 5.5416e-03 6.7160e-04 -4.3467e-04 7.0663e-05 2.9405e-05 -6.0000e+00 4.2063e-04 -2.5686e-03 1.2544e-05 12 1 1 12 1 1 99.99 22.26 0.08 -0.00257 -0.00583 31 19 1 5 0 511.183 25.39 20.00 22.26 23.71 27.2 1002.98 -5540 -6458 -4235 -1701 -4588 840 -6108 3527 -2029 2711 -136 482 361 -1978 936 -2874 294 -2723 146 -217 267 -230 242 1836 507 196 -2017 899 -392 1778 2211 1214 601 -666 387 -1264 284 -890 -318 -1880 -937 -1174 -768 -318 -894 381 -310 175 -954 928 536 954 1301 600 1103 211 1029 333 417 684 1515 1235 1172 561 -225 756 -631 904 582 396 -197 286 -147 -150 186 -195 585 -199 775 -420 -354 -1536 -1422 -1548 -1141 -995 -420 -276 -547 -91 142 421 743 1090 957 737 1047 536 -5 -609 -193 -670 87 -54 -784 -606 -379 -185 -329 25 -182 150 -107 -17 88 481 546 325 131 -439 -413 -131 -227 -13 470 394 905 1293 840 485 -96 403 25 274 -125 77 262 -25 -436 -483 -199 -579 -74 -473 -607 -400 -150 -385 65 -528 310 -207 279 -15 54 44 -283 148 -515 54 -539 29 -45 56 -49 53 415 122 49 -516 216 -91 398 517 309 165 -190 106 -350 83 -300 -125 -853 -460 -606 -406 -170 -481 203 -164 91 -496 479 289 543 779 378 713 141 693 226 280 456 1025 882 893 451 -184 589 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