File name: Pandora21s1_Bremen_20210625_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T075245.4Z 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_20210625_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: 20210625 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 20210625T065354.6Z 7846.287437 284 1 50.57 2 58.65 92.15 119.14 264.18 0.00 1 0.00 1 0 25 1.857e-02 5.823e-03 1.476e-02 3.164e-03 2.796655e-01 1.670039e-03 3.700205e-03 -6.000000e+00 1.129997e-02 233.75 -2.00 3.88 -2.00 318.21 0.00e+00 5.310170e-04 2.706794e-04 8.436695e-05 -6.000000e+00 4.449618e-04 280.89 -2.00 20.00 -2.00 317.87 0.00e+00 1.915 0.000 302.00 328.00 3 5.3688e+00 4.5032e-03 2.5386e-02 -6.0000e+00 2.8677e-02 2.4202e-02 5.0257e-03 1.6398e-02 -6.0000e+00 3.1036e-02 1.5365e-02 3.2535e-03 8.0536e-03 -6.0000e+00 1.8159e-02 -9.9852e-03 1.6516e-03 2.2680e-03 -6.0000e+00 7.4341e-03 2.5454e-04 -6.5511e-04 1.0078e-04 2.8014e-05 -6.0000e+00 5.5873e-04 2.3287e-03 -3.8010e-05 10 0 0 10 0 0 99.99 22.36 0.24 0.00233 -0.00259 56 11 1 5 0 902.796 25.39 20.00 22.36 25.14 25.0 1024.56 -436 -1861 -1995 1210 2490 -9683 1928 -3326 7062 -3126 4693 -8170 -3394 -4837 1187 1583 -899 87 -1730 973 -3241 4276 -1262 2059 -900 -1307 2113 -796 5242 -243 1391 3254 306 -2685 -970 2126 -1669 -169 -1698 -498 -1548 123 -1488 -379 -1633 -1943 -1528 -788 1493 -61 1452 503 1210 884 812 961 880 671 655 887 736 676 950 1064 -406 577 177 814 1217 536 72 -791 215 -743 173 46 548 331 -257 -462 -897 -511 -1786 -879 -642 -405 -404 245 99 -243 742 244 805 756 904 -83 1237 197 -638 -394 -874 -79 -125 339 -744 -263 -884 -89 136 -198 206 58 -119 -458 289 323 392 251 -20 -279 -882 148 -284 -145 373 532 812 1427 373 84 374 295 293 214 303 -109 107 232 -479 -310 102 -486 -476 -30 -140 -154 86 163 -685 129 -259 548 -280 397 -812 -358 -591 156 227 -140 14 -296 168 -596 736 -234 389 -185 -279 435 -162 958 -46 275 684 71 -659 -227 479 -419 -48 -583 -195 -671 55 -700 -179 -783 -935 -725 -364 669 -28 688 256 649 500 475 575 536 410 396 534 455 445 671 793 -309 415 120 536 838 410 60 -697 189 -641 140 34 370 214 -172 -340 -737 -458 -1732 -889 -686 -458 -482 300 122 -292 836 255 779 707 874 -87 1419 249 -859 -532 -1135 -96 -143 391 -917 -340 -1202 -125 199 -307 334 95 -194 -710 416 440 525 345 -29 -428 -1401 233 -440 -218 534 729 1068 1847 507 122 568 460 468 352 521 -196 198 438 -916 -585 187 -869 -833 SS 20210625T071005.0Z 7846.298669 296 1 12.94 2 56.23 95.48 121.44 267.18 0.00 1 0.00 1 0 17 1.838e-02 6.410e-03 1.123e-02 3.845e-03 2.667151e-01 2.041509e-03 3.532663e-03 -6.000000e+00 1.118365e-02 233.75 -2.00 3.88 -2.00 317.03 0.00e+00 2.016781e-05 2.471966e-04 5.950100e-05 -6.000000e+00 4.402270e-04 280.89 -2.00 20.00 -2.00 316.71 0.00e+00 1.793 0.000 302.00 328.00 3 5.3067e+00 5.4227e-03 2.3908e-02 -6.0000e+00 2.8382e-02 3.7188e-02 6.0181e-03 1.5526e-02 -6.0000e+00 3.0714e-02 4.9880e-03 3.5903e-03 7.5752e-03 -6.0000e+00 1.7971e-02 -3.9640e-03 1.7195e-03 2.1008e-03 -6.0000e+00 7.3596e-03 3.1070e-04 -2.8594e-04 1.1899e-04 2.6523e-05 -6.0000e+00 5.5272e-04 1.4508e-03 3.6967e-05 12 9 1 12 1 1 99.92 22.37 0.17 0.00145 -0.00070 4 4 1 5 0 2552.745 25.39 20.00 22.37 25.75 25.0 1027.42 -40 -4990 -1907 3297 -13363 4428 -1664 9330 -2800 1563 -1958 356 -2092 348 1498 -425 193 -3420 2111 1024 23 34 1301 -839 506 -450 -353 1981 -1528 3687 2302 1433 2352 123 1336 -486 -1558 -573 1027 -1440 -892 -1003 0 -1358 -158 -783 -1124 -74 -1897 -268 128 729 -165 1192 69 126 497 -600 784 816 1722 2088 824 557 76 1288 -217 -218 497 1006 -76 343 -388 638 -675 1071 -1242 -679 -115 -458 -1031 -1110 -1634 -1008 -473 -1265 -582 -189 -67 319 500 509 1257 1566 234 987 641 336 -355 -102 -7 -916 -100 293 -497 -605 -570 -544 263 128 -7 -220 85 -134 64 402 200 238 331 -61 -436 -495 54 -330 80 627 218 831 173 980 250 114 -9 415 77 -104 109 222 -345 -302 -320 -511 -26 -5 -655 -248 389 -1701 461 -193 1082 -399 225 -294 54 -358 66 315 -99 47 -892 543 275 6 10 364 -250 157 -145 -113 598 -453 1029 677 455 788 43 449 -164 -566 -235 480 -774 -515 -605 0 -851 -98 -488 -694 -45 -1146 -161 79 473 -113 839 50 93 373 -455 583 605 1293 1639 691 488 67 1083 -175 -173 406 885 -72 335 -383 612 -625 915 -1005 -526 -91 -389 -955 -1103 -1715 -1094 -534 -1502 -715 -236 -84 393 589 565 1311 1584 245 1090 761 427 -471 -135 -8 -1129 -118 348 -619 -785 -763 -749 373 188 -11 -340 128 -197 90 535 263 319 462 -88 -649 -737 79 -472 111 839 283 1068 230 1353 359 167 -13 631 122 -168 182 373 -585 -508 -528 -826 -42 SS 20210625T071524.6Z 7846.302368 299 1 52.55 2 55.43 96.60 122.19 268.18 0.00 1 0.00 1 0 25 7.981e-03 5.102e-03 6.560e-04 2.096e-04 2.590518e-01 1.109052e-04 3.432363e-03 -6.000000e+00 4.856236e-03 233.75 -2.00 3.88 -2.00 317.27 0.00e+00 1.630634e-04 1.416437e-05 5.914760e-05 -6.000000e+00 1.912008e-04 280.89 -2.00 20.00 -2.00 316.95 0.00e+00 1.757 0.000 302.00 328.00 3 9.8069e-01 2.9533e-04 2.3337e-02 -6.0000e+00 1.2324e-02 4.3486e-03 3.2800e-04 1.5088e-02 -6.0000e+00 1.3338e-02 1.1744e-03 1.9749e-04 7.3683e-03 -6.0000e+00 7.8038e-03 -2.9340e-03 9.5558e-05 2.0468e-03 -6.0000e+00 3.1951e-03 2.5112e-02 -3.1622e-04 6.5434e-06 2.5419e-05 -6.0000e+00 2.4007e-04 2.1523e-03 -5.1054e-06 10 0 0 10 0 0 99.75 22.37 0.24 0.00215 -0.00022 1916 376 1 5 0 25.778 25.47 19.99 22.37 26.09 25.2 1030.65 -2625 -2869 -2864 -2878 -2284 -1318 -1223 -371 -445 -961 -649 -249 -329 -496 -352 -696 -269 -166 250 38 361 750 809 435 176 0 -462 85 709 1062 1058 1387 492 -617 -456 -314 -582 -214 -419 -947 -890 -849 -797 -692 -525 -584 -626 -557 -195 543 590 782 911 729 658 765 702 593 826 1027 1259 1227 1104 418 -54 167 167 554 839 389 -191 -209 -289 -298 -134 86 287 529 505 -179 -549 -1174 -1361 -1132 -1011 -863 -499 -358 -231 -133 210 283 743 1077 893 698 788 298 -332 -506 -392 -457 194 148 -576 -562 -569 -381 3 54 -40 -124 -116 -49 162 527 565 445 154 -313 -502 -209 -230 28 341 385 951 1088 723 499 271 154 179 357 -28 -114 44 -75 -395 -253 -330 -374 -229 -289 -344 -349 -332 -239 -131 -128 -43 -57 -129 -88 -35 -51 -87 -70 -152 -62 -40 62 10 94 195 214 121 52 0 -140 25 192 281 292 412 158 -205 -146 -99 -198 -84 -181 -477 -492 -494 -478 -419 -317 -352 -371 -322 -111 307 348 492 607 474 443 527 492 416 570 704 885 920 894 360 -47 137 127 409 648 335 -181 -195 -271 -290 -122 71 214 402 394 -144 -498 -1183 -1377 -1207 -1147 -1046 -597 -443 -287 -161 252 311 745 1107 888 759 948 372 -445 -680 -500 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