File name: Pandora21s1_Bremen_20210425_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T070723.3Z 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_20210425_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: 20210425 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 20210425T061827.9Z 7785.262822 253 1 7.71 2 71.07 92.99 111.54 301.57 0.00 1 0.00 1 0 25 1.730e-01 9.388e-03 1.661e-01 8.486e-03 4.927293e-01 4.463254e-03 6.355920e-03 -6.000000e+00 1.040985e-01 228.75 -2.00 3.88 -2.00 319.48 0.00e+00 3.162620e-03 1.110177e-03 2.655537e-04 -6.000000e+00 4.154734e-03 273.48 -2.00 20.00 -2.00 319.19 0.00e+00 3.046 0.001 302.00 328.00 3 4.5878e+00 1.2272e-02 4.1763e-02 -6.0000e+00 2.6107e-01 5.9095e-02 1.4207e-02 2.8327e-02 -6.0000e+00 2.8372e-01 -2.8005e-02 1.2270e-02 1.4464e-02 -6.0000e+00 1.6607e-01 4.8022e-03 6.5877e-03 4.3198e-03 -6.0000e+00 6.8426e-02 1.3697e-04 -5.8324e-04 2.5793e-04 5.2197e-05 -6.0000e+00 5.2482e-03 9.1470e-04 -4.2381e-05 12 9 9 12 1 1 999.00 22.33 0.26 0.00091 -0.00347 2 4 1 5 0 2510.451 25.28 19.99 22.33 13.90 23.6 1014.01 38427 14555 -9942 -90726 114204 -68885 900000 1420 -12210 -44390 -35011 72859 -28551 1803 -10423 27472 5767 -824 5330 -3882 11718 -16932 -6259 -11702 6453 -2334 944 17172 -13590 -1661 -10356 14824 -1889 10410 -9657 16487 1397 6941 -1697 -2538 -4478 1307 4099 -1003 703 -357 1786 -2765 -1315 4236 4575 1025 563 1857 962 2817 -2189 -560 -256 -277 -677 621 1314 947 1173 139 828 -1681 1119 -483 1 -1071 -88 974 -691 4626 -1615 -189 -291 2252 -1686 -233 -2537 -1143 -109 -1374 249 130 807 -186 409 738 -577 1105 1000 1058 783 619 -1034 -697 -163 -1056 485 381 -752 -1303 -193 -259 -401 -1 -247 -290 65 323 497 1131 343 -83 505 -1162 -986 -51 250 -347 46 540 1268 1224 511 650 -800 350 272 963 135 -28 -217 -538 -416 -202 79 -18 -328 388 206 -185 -3412 945 -1970 900000 25 -270 -1397 -1061 924 -1063 62 -479 1029 291 -48 311 -259 696 -1323 -457 -953 472 -193 77 1178 -1226 -140 -1059 1370 -227 1176 -1294 1734 183 999 -314 -549 -1093 323 1030 -271 190 -99 491 -801 -385 1232 1422 357 212 734 400 1189 -984 -248 -112 -120 -303 295 677 527 674 79 455 -947 656 -316 1 -791 -65 684 -463 2744 -944 -107 -175 1483 -1282 -192 -2281 -1066 -105 -1413 264 141 873 -198 415 704 -531 1000 956 1104 900 774 -1382 -938 -211 -1294 558 436 -904 -1642 -250 -350 -568 -1 -392 -475 106 511 755 1651 498 -124 778 -1869 -1603 -81 390 -531 68 773 1763 1710 755 1023 -1341 604 483 1752 257 -56 -436 -1096 -848 -405 154 -34 -609 SS 20210425T063420.3Z 7785.273847 260 1 48.69 2 68.69 96.23 113.51 305.09 0.00 1 0.00 1 0 25 1.473e-01 7.992e-03 1.157e-01 5.396e-03 4.541945e-01 2.865975e-03 5.803552e-03 -6.000000e+00 8.808678e-02 228.75 -2.00 3.88 -2.00 320.03 0.00e+00 -1.481689e-03 7.954621e-04 2.804501e-04 -6.000000e+00 3.528495e-03 273.48 -2.00 20.00 -2.00 319.71 0.00e+00 2.727 0.000 302.00 328.00 3 3.7894e+00 8.0531e-03 3.7968e-02 -6.0000e+00 2.2086e-01 -1.2651e-01 9.4689e-03 2.6196e-02 -6.0000e+00 2.3985e-01 1.6027e-01 8.5330e-03 1.3590e-02 -6.0000e+00 1.4089e-01 -6.6927e-02 4.5320e-03 4.1691e-03 -6.0000e+00 5.8335e-02 4.5674e-04 2.2270e-04 1.7483e-04 5.2490e-05 -6.0000e+00 4.4235e-03 -8.4098e-04 1.4946e-04 11 8 0 10 0 0 99.99 22.33 0.08 -0.00084 0.00083 1328 261 1 5 0 34.896 25.28 19.99 22.33 15.47 23.7 1021.74 20668 67340 8050 -26383 66064 114527 19014 -2555 -16061 49777 -19825 27862 500 14210 -10356 7348 18162 10350 3218 -9013 -4613 2796 11149 1686 -3511 4277 7519 -7165 12720 3897 3512 1606 1642 6206 13096 282 12454 5497 4006 -1075 -4980 -4358 -3030 -6666 -1969 -1459 -3183 -2898 -671 -715 -1917 2785 -17 -1145 167 -1117 1514 1012 -264 1769 1957 1963 474 -1993 269 598 17 8 -777 576 -1223 -1213 339 352 732 1261 2675 3615 3218 1103 -1144 -1188 -686 -1012 -1577 -1150 -1130 14 -731 109 277 1120 2333 3136 1793 1752 699 458 -297 -816 -375 252 1598 593 -888 -1089 -815 -273 45 -415 -125 -343 -159 -239 263 484 818 699 -88 -275 -1150 -737 -638 -633 332 382 1174 1460 374 619 22 57 -320 407 13 -411 257 17 -144 -66 -142 -67 85 285 731 141 -583 727 876 316 -55 -421 879 -600 646 16 467 -462 321 793 509 176 -562 -288 169 661 115 -266 322 561 -586 882 294 287 147 164 629 1252 30 1292 688 595 -192 -1015 -942 -674 -1562 -448 -334 -746 -682 -158 -175 -507 767 -5 -375 57 -400 546 369 -96 631 715 766 204 -949 130 281 8 4 -384 313 -738 -771 214 214 418 659 1281 1677 1582 619 -742 -857 -534 -839 -1397 -1079 -1117 14 -746 107 258 964 1876 2477 1520 1645 742 542 -380 -1060 -464 286 1685 629 -1009 -1313 -1029 -361 63 -631 -203 -582 -268 -388 401 699 1160 1019 -136 -448 -1922 -1212 -1018 -977 487 538 1583 1966 542 974 38 102 -593 783 27 -885 567 38 -327 -147 -305 -137 168 SS 20210425T064324.5Z 7785.280144 266 1 48.94 2 67.34 98.11 114.60 307.15 0.00 1 0.00 1 0 25 1.630e-02 4.393e-03 8.941e-03 7.077e-04 4.198806e-01 3.727610e-04 5.471810e-03 -6.000000e+00 9.737110e-03 228.75 -2.00 3.88 -2.00 319.48 0.00e+00 3.639152e-04 8.974189e-05 2.133657e-04 -6.000000e+00 3.904309e-04 273.48 -2.00 20.00 -2.00 319.18 0.00e+00 2.575 0.000 302.00 328.00 3 1.7800e+00 1.0263e-03 3.5501e-02 -6.0000e+00 2.4412e-02 1.5736e-02 1.1788e-03 2.4210e-02 -6.0000e+00 2.6520e-02 5.7298e-03 9.7117e-04 1.2362e-02 -6.0000e+00 1.5578e-02 -1.0942e-02 5.1979e-04 3.6998e-03 -6.0000e+00 6.4433e-03 4.0042e-03 -5.7014e-04 2.2443e-05 4.6613e-05 -6.0000e+00 4.8955e-04 2.5510e-03 6.7460e-06 10 0 0 10 0 0 99.98 22.33 0.14 0.00255 -0.00173 1065 209 1 5 0 44.235 25.28 20.00 22.33 15.33 23.3 1016.95 -4897 -8576 -1436 223 -7869 4549 -6820 4678 -4987 -844 -1471 599 -155 -579 1064 -2551 519 -1609 953 -1167 294 947 226 151 -1040 610 -2792 -275 -1279 1954 -12 1364 278 -626 -1257 -1241 -34 -1584 -750 -2161 -1549 -1577 -1323 -1145 -981 -675 -899 -495 -570 596 10 742 420 497 526 596 380 290 843 962 1332 1292 1182 538 255 578 321 915 679 692 -259 -98 -202 139 53 279 612 442 715 -282 -390 -1086 -1218 -1096 -980 -746 -316 -193 -146 236 470 670 761 1226 986 705 801 241 -236 -507 -239 -384 279 -4 -764 -692 -612 -294 -67 96 -108 -88 -99 43 223 584 468 349 -48 -515 -598 -200 -286 -122 178 198 847 1029 503 371 102 137 84 315 -144 -148 68 19 -258 -171 -122 -189 22 -109 -222 -36 5 -190 95 -171 118 -145 -25 -46 20 -6 -27 55 -155 33 -113 69 -91 23 75 19 13 -100 60 -288 -27 -121 183 -1 158 36 -85 -169 -166 -5 -256 -145 -497 -395 -430 -374 -329 -284 -196 -261 -143 -167 178 3 258 158 200 222 260 170 130 369 417 591 616 620 307 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