File name: Pandora21s1_Bremen_20211021_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T092004.4Z 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_20211021_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: 20211021 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 20211021T091123.1Z 7964.382906 343 1 2.13 2 68.70 148.73 108.30 320.38 0.00 1 0.00 1 0 25 3.211e-02 7.137e-03 1.976e-02 3.931e-03 3.836356e-01 2.020777e-03 5.136797e-03 -6.000000e+00 1.884069e-02 223.57 -2.00 3.88 -2.00 317.93 0.00e+00 6.284429e-04 3.240836e-04 1.215565e-04 -6.000000e+00 7.691701e-04 274.50 -2.00 20.00 -2.00 317.64 0.00e+00 2.728 0.000 302.00 328.00 3 2.7306e+00 5.3328e-03 3.4520e-02 -6.0000e+00 4.6686e-02 5.3711e-02 5.9835e-03 2.1428e-02 -6.0000e+00 5.0877e-02 -2.6295e-02 3.9440e-03 1.0837e-02 -6.0000e+00 3.0002e-02 6.6463e-03 2.0579e-03 3.1900e-03 -6.0000e+00 1.2563e-02 1.4210e-03 -7.8884e-04 1.1974e-04 3.9673e-05 -6.0000e+00 9.6294e-04 -7.9629e-03 -2.0044e-07 12 9 1 12 1 1 94.69 22.17 0.12 -0.00796 -0.01389 5 30 1 5 0 325.363 25.28 19.99 22.17 16.75 27.2 979.37 -4554 -19422 -7369 -7819 -19615 5749 -198 8781 -13179 3641 -5212 292 1284 36 -2859 -5406 2663 139 1127 -165 1442 3190 -2246 1444 -1241 327 -884 2173 -1308 4552 -3372 2180 -236 1119 -873 -1002 639 56 456 -2072 -378 -672 -918 -486 -872 253 -524 1301 -285 992 519 1343 1436 -111 -420 747 706 -88 1280 825 1622 650 1295 -60 -224 159 235 701 1286 700 124 252 -97 -317 -899 -240 -330 969 2025 -685 -836 -1655 -1607 -1756 -1658 -915 -296 -455 74 233 -476 803 648 1193 1205 794 1168 -201 -121 -602 24 -712 975 458 -603 -637 -817 -561 137 92 -834 188 -317 -264 434 416 1400 453 -4 -688 -496 -283 132 -350 681 457 467 1040 1166 433 352 219 -243 384 -256 -264 232 -111 -427 -146 -134 -467 -183 -265 -1431 -507 -524 -1364 310 -12 534 -1074 271 -433 24 121 4 -374 -806 398 22 189 -29 256 562 -424 279 -259 70 -192 448 -269 894 -755 511 -61 298 -232 -265 176 18 165 -863 -169 -316 -446 -239 -432 125 -260 634 -141 496 272 741 834 -68 -266 481 462 -58 827 531 1057 447 942 -46 -177 123 174 514 976 573 108 228 -89 -283 -772 -193 -250 708 1512 -561 -746 -1592 -1628 -1848 -1811 -1036 -345 -542 89 274 -540 863 667 1204 1253 880 1385 -257 -162 -810 31 -891 1160 546 -747 -819 -1083 -766 193 135 -1280 293 -495 -401 631 585 1933 639 -6 -1039 -761 -432 197 -517 974 637 636 1406 1626 636 538 344 -390 628 -432 -461 410 -200 -772 -261 -234 -800 -308 SS 20211021T094446.2Z 7964.406090 358 1 49.63 2 66.44 157.25 111.02 328.26 0.00 1 0.00 1 0 25 8.599e-03 4.738e-03 3.917e-03 5.437e-04 3.489099e-01 2.782018e-04 4.644765e-03 -6.000000e+00 5.045211e-03 223.57 -2.00 3.88 -2.00 318.79 0.00e+00 3.533506e-04 5.562074e-05 1.355992e-04 -6.000000e+00 2.059632e-04 274.49 -2.00 20.00 -2.00 318.49 0.00e+00 2.483 0.000 302.00 328.00 3 1.5815e+00 7.4677e-04 3.1452e-02 -6.0000e+00 1.2502e-02 3.0548e-02 8.4614e-04 1.9574e-02 -6.0000e+00 1.3624e-02 -1.9878e-03 6.1091e-04 9.9866e-03 -6.0000e+00 8.0338e-03 -6.2290e-03 3.2562e-04 2.9885e-03 -6.0000e+00 3.3643e-03 5.9938e-03 -5.1910e-04 1.7231e-05 3.7667e-05 -6.0000e+00 2.5785e-04 -7.7305e-03 1.5498e-05 10 0 0 10 0 0 99.99 22.17 0.18 -0.00773 -0.01163 1293 254 1 5 0 36.541 25.28 20.00 22.17 16.78 27.0 979.68 -1713 -2305 -1660 -3474 -576 -1325 -2057 -1513 -2860 -2760 -701 -684 -381 -602 -627 -1060 -460 -705 112 -376 -201 431 -259 211 -107 -556 -1350 -351 351 143 431 988 831 -744 -984 -482 -986 -416 -908 -1251 -1410 -1085 -1479 -892 -510 -698 -571 -603 -409 391 462 690 843 746 815 766 690 446 626 1035 1183 1245 1229 710 -58 293 331 725 899 560 -101 -98 -181 -193 40 260 415 507 640 -148 -498 -1046 -1463 -1144 -923 -859 -466 -297 -96 -21 359 457 947 1102 1009 782 757 341 -322 -497 -333 -434 298 235 -664 -621 -566 -400 -8 40 -95 -197 -151 -76 199 585 553 420 131 -482 -608 -202 -285 -88 216 284 825 1087 649 390 174 -5 182 292 -66 -153 90 29 -328 -207 -205 -264 -1 -68 -102 -76 -155 -25 -55 -91 -69 -148 -152 -39 -40 -25 -47 -57 -108 -50 -82 14 -47 -26 56 -34 30 -16 -88 -215 -53 50 21 66 166 153 -145 -187 -90 -198 -97 -238 -384 -483 -394 -559 -341 -195 -268 -217 -227 -154 149 185 298 389 365 416 403 371 241 331 541 632 710 765 477 -40 194 207 442 577 402 -80 -78 -143 -157 30 179 260 303 396 -103 -394 -927 -1328 -1097 -938 -933 -533 -351 -113 -24 387 453 866 1036 991 797 864 433 -418 -655 -442 -533 339 268 -807 -804 -769 -540 -11 61 -154 -332 -251 -119 292 849 785 612 191 -751 -976 -321 -442 -132 308 409 1129 1470 928 570 273 -8 307 510 -123 -282 172 56 -650 -404 -385 -502 -1 SS 20211021T104344.5Z 7964.447043 397 1 1.39 2 64.18 173.01 114.36 342.92 0.00 1 0.00 1 0 25 1.848e-02 7.750e-03 1.573e-02 5.122e-03 3.210761e-01 2.634602e-03 4.339229e-03 -6.000000e+00 1.084169e-02 223.56 -2.00 3.88 -2.00 317.09 0.00e+00 -7.344690e-05 3.365322e-04 7.486591e-05 -6.000000e+00 4.424954e-04 274.49 -2.00 20.00 -2.00 316.79 0.00e+00 2.282 0.000 302.00 328.00 3 3.1333e+00 6.8580e-03 2.8857e-02 -6.0000e+00 2.6865e-02 3.0144e-02 7.6711e-03 1.7888e-02 -6.0000e+00 2.9274e-02 -1.7446e-02 4.6582e-03 9.0112e-03 -6.0000e+00 1.7263e-02 5.0264e-03 2.3044e-03 2.6304e-03 -6.0000e+00 7.2311e-03 1.6127e-03 -1.8026e-04 1.5608e-04 3.3967e-05 -6.0000e+00 5.5397e-04 -9.0183e-03 3.5830e-05 12 9 1 12 1 1 999.00 22.21 0.33 -0.00902 -0.01037 2 24 1 5 0 403.852 25.28 20.00 22.21 17.57 27.2 983.12 -2037 -8056 2381 -7817 -3214 428 -5882 7339 -1096 -574 -3117 4513 -2842 508 -2010 2163 -2638 -257 5673 -3826 1523 631 2944 -113 3458 -1600 -488 -1040 2062 1300 -255 3789 -1078 1503 -1134 -399 463 -1278 237 -381 -1337 -2701 -291 -1556 -242 -1278 -265 -1039 791 -1419 16 623 882 924 896 821 937 1023 948 1482 1464 1004 2094 813 -523 -254 601 395 958 464 -1140 64 -1005 -183 -345 415 -46 720 1198 -410 -1189 -1164 -1707 -538 -818 -1824 -504 -376 -130 139 435 1207 203 1380 84 1119 1316 720 -775 -133 -605 -327 142 323 -1146 -702 -593 -1204 590 -112 -61 -71 -178 -84 -193 1079 251 668 211 -155 -124 -735 -462 -482 684 523 1419 796 806 665 448 -456 694 195 131 -19 -243 89 -626 -525 -91 -379 -148 -216 -984 273 -944 -347 43 -657 806 -142 -78 -443 627 -464 91 -417 474 -636 -63 1383 -1037 404 169 790 -33 1016 -506 -153 -318 591 372 -77 1196 -376 530 -399 -138 168 -525 109 -198 -750 -1593 -173 -942 -145 -774 -158 -619 464 -854 10 401 593 644 641 600 693 757 696 1078 1081 775 1691 690 -453 -214 485 314 785 408 -1070 61 -978 -174 -315 357 -37 566 959 -354 -1109 -1157 -1783 -577 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