File name: Pandora21s1_Bremen_20210818_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T084503.5Z 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_20210818_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: 20210818 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 20210818T092127.0Z 7900.389896 235 1 50.59 2 47.40 135.78 147.65 42.36 0.00 1 0.00 1 0 17 1.146e-02 5.711e-03 7.623e-03 3.072e-03 2.055494e-01 1.621404e-03 2.729049e-03 -6.000000e+00 6.941784e-03 232.24 -2.00 3.88 -2.00 316.85 0.00e+00 1.946836e-04 1.861781e-04 4.081201e-05 -6.000000e+00 2.746283e-04 282.51 -2.00 20.00 -2.00 316.52 0.00e+00 1.475 0.000 302.00 328.00 3 5.9943e+00 4.2833e-03 1.9012e-02 -6.0000e+00 1.7552e-02 5.3424e-02 4.7572e-03 1.1867e-02 -6.0000e+00 1.9012e-02 9.3493e-04 2.7947e-03 5.8082e-03 -6.0000e+00 1.1138e-02 -2.9806e-03 1.3074e-03 1.6258e-03 -6.0000e+00 4.5780e-03 2.3808e-04 -5.3753e-05 9.6559e-05 2.1025e-05 -6.0000e+00 3.4462e-04 -2.5264e-03 2.4726e-05 10 0 0 10 0 0 99.96 22.25 0.40 -0.00253 -0.00293 34 7 1 5 0 1487.588 25.39 20.00 22.25 21.70 26.8 1008.59 434 -5030 2986 -3189 2374 -4682 170 -91 2018 1697 -3978 2222 -1156 -980 -639 705 -2167 1784 2038 -263 387 367 2000 -929 507 -6 -274 140 472 -3 119 1624 -235 -1290 -2436 619 -2219 225 -578 -904 -450 -719 582 -1733 -310 -449 -624 -1500 300 509 63 801 808 1267 730 1470 178 601 94 1033 756 611 1834 746 1494 -1121 28 -549 781 16 412 -2 137 386 -42 159 -465 -1168 -678 -602 -445 -1698 -1192 -833 -395 -1130 -14 -23 598 262 183 117 -294 155 -143 471 -64 439 -224 -60 79 -310 -516 -130 -621 -859 -492 -148 541 197 817 36 27 28 -574 139 -199 -119 -61 168 -337 142 378 272 331 -69 524 475 417 -306 691 -130 32 820 209 -206 187 232 -303 196 -257 -492 -797 66 -862 480 -513 331 -667 24 -14 339 298 -739 397 -231 -219 -159 186 -613 500 588 -80 119 113 613 -305 172 -2 -95 46 147 -1 37 528 -82 -464 -853 207 -813 92 -280 -502 -271 -453 372 -1142 -201 -290 -397 -934 179 303 39 518 549 892 531 1082 134 452 70 763 573 489 1547 665 1321 -959 22 -420 613 14 385 -2 135 371 -38 133 -358 -854 -502 -482 -392 -1645 -1222 -891 -444 -1357 -18 -30 770 330 218 129 -301 152 -143 503 -74 552 -298 -79 101 -372 -594 -151 -766 -1121 -667 -207 782 298 1277 57 42 42 -794 180 -254 -155 -84 243 -506 213 557 390 454 -91 660 589 533 -415 968 -188 46 1221 326 -337 313 396 -525 336 -432 -804 -1280 SS 20210818T100008.4Z 7900.416764 257 1 51.90 2 43.82 148.00 143.54 55.07 0.00 1 0.00 1 0 17 1.102e-02 7.067e-03 9.675e-03 4.170e-03 2.001906e-01 2.204787e-03 2.635838e-03 -6.000000e+00 6.674401e-03 232.24 -2.00 3.88 -2.00 316.63 0.00e+00 4.179587e-04 2.411633e-04 3.834438e-05 -6.000000e+00 2.639911e-04 282.51 -2.00 20.00 -2.00 316.31 0.00e+00 1.384 0.000 302.00 328.00 3 6.6907e+00 5.8099e-03 1.8092e-02 -6.0000e+00 1.6876e-02 7.3886e-02 6.4480e-03 1.1487e-02 -6.0000e+00 1.8279e-02 1.4161e-03 3.7641e-03 5.6181e-03 -6.0000e+00 1.0708e-02 -3.3490e-03 1.7432e-03 1.5709e-03 -6.0000e+00 4.4025e-03 1.2957e-04 -1.1061e-05 1.3071e-04 2.0188e-05 -6.0000e+00 3.3126e-04 -3.1408e-03 5.7976e-05 11 8 0 10 0 0 99.72 22.26 0.30 -0.00314 -0.00322 13 3 1 5 0 3989.153 25.39 20.00 22.26 23.86 26.6 1017.11 252 -1517 -218 1671 -2610 -59 -994 1336 -2831 -5980 -360 -2140 -1628 670 -573 1238 2142 -681 -1214 3182 1244 1871 877 731 380 664 -342 -686 1273 1619 -453 -1426 921 -520 -2035 634 -917 -642 -919 483 -36 221 -845 -511 -557 -673 -357 -2237 -707 -245 95 851 -477 911 1372 826 178 937 204 149 916 719 1078 745 860 483 -961 -858 -131 -202 962 439 1034 781 -9 -627 -1396 -2017 -1554 -744 -1140 -1265 -2039 -793 -750 -55 808 1077 1056 629 334 -151 -918 -678 745 -323 31 569 651 450 24 -748 -518 -748 -1068 -1454 -609 -65 742 192 767 311 595 -521 -341 -576 -1098 -814 -358 210 380 570 557 528 193 8 115 459 163 -177 167 107 336 -132 348 408 96 -2 -160 490 58 -869 -811 42 -274 -39 280 -415 -9 -154 223 -537 -1219 -69 -428 -351 158 -152 349 623 -209 -386 997 404 604 289 251 137 245 -126 -242 415 510 -149 -502 335 -195 -746 222 -348 -278 -467 276 -22 144 -570 -347 -378 -454 -236 -1459 -444 -153 60 569 -339 665 1023 630 138 723 156 114 712 591 940 681 784 418 -782 -673 -106 -179 910 437 1030 761 -8 -539 -1103 -1510 -1174 -604 -1023 -1235 -2128 -857 -854 -66 1012 1387 1368 798 402 -169 -952 -670 741 -348 36 715 860 597 31 -903 -596 -872 -1321 -1904 -824 -91 1067 290 1193 492 915 -767 -467 -744 -1396 -1057 -488 301 563 845 811 746 263 11 143 562 205 -236 231 151 482 -194 533 651 158 -4 -271 820 95 -1400 -1278 SS 20210818T100529.9Z 7900.420485 260 1 2.16 2 43.41 149.80 142.91 56.66 0.00 1 0.00 1 0 17 1.108e-02 7.462e-03 7.922e-03 5.341e-03 1.851176e-01 2.874646e-03 2.456985e-03 -6.000000e+00 6.708914e-03 232.23 -2.00 3.88 -2.00 314.99 0.00e+00 3.990161e-05 2.225312e-04 2.108945e-05 -6.000000e+00 2.654296e-04 282.51 -2.00 20.00 -2.00 314.72 0.00e+00 1.375 0.000 302.00 328.00 3 4.5012e+00 7.4641e-03 1.7412e-02 -6.0000e+00 1.6963e-02 2.1908e-02 8.2450e-03 1.0598e-02 -6.0000e+00 1.8375e-02 3.4846e-03 4.6910e-03 5.1665e-03 -6.0000e+00 1.0764e-02 2.1960e-05 2.0193e-03 1.4308e-03 -6.0000e+00 4.4245e-03 1.2316e-03 -1.4663e-05 1.6373e-04 2.0662e-05 -6.0000e+00 3.3308e-04 -2.9960e-03 1.7831e-06 12 9 1 12 1 1 999.00 22.26 0.33 -0.00300 -0.00311 1 10 1 5 0 991.691 25.39 20.00 22.26 23.84 26.7 1017.32 -574 -3380 -3582 -1471 2566 380 -2786 1256 153 2638 -2965 261 1467 1124 -515 -1791 -723 -340 1818 -399 3594 1636 1367 1057 1528 458 -1524 939 -1547 2521 -783 1850 1115 420 426 -144 -512 1320 1501 -2210 -911 -1645 676 -568 -1144 -1642 -855 -712 -1109 -755 -565 371 -536 1235 120 1636 28 -112 690 887 1035 664 1094 823 -555 270 -769 522 376 265 1 145 -849 45 -79 492 -731 1540 768 -730 -228 -899 -1700 -1406 -718 -808 773 -22 350 -585 296 126 457 553 444 -363 1089 254 546 -726 -278 673 1018 223 -139 -674 -304 -360 -357 -17 -201 202 -414 -426 592 606 -230 220 447 -551 -276 -519 -412 -426 176 137 1449 1002 891 61 140 -22 202 106 275 -633 567 74 -297 -679 -639 512 -242 -182 -1151 -1229 -474 747 108 -840 397 52 911 -1065 93 546 455 -227 -839 -345 -165 886 -201 1785 823 696 554 824 254 -849 497 -796 1234 -398 960 603 231 227 -76 -285 796 1005 -1653 -714 -1331 548 -466 -942 -1349 -691 -563 -864 -585 -446 301 -451 1055 105 1434 25 -100 609 782 925 616 1052 815 -553 257 -705 464 342 255 1 151 -897 46 -79 466 -657 1315 664 -671 -222 -926 -1828 -1554 -818 -957 937 -27 436 -721 350 142 488 573 466 -400 1255 309 685 -919 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