File name: Pandora21s1_Bremen_20210429_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T070908.1Z 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_20210429_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: 20210429 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 20210429T120943.7Z 7789.506756 464 1 1.37 2 39.60 198.26 145.55 322.22 0.00 1 0.00 1 0 25 1.138e-02 7.890e-03 1.007e-02 5.807e-03 2.291398e-01 3.080236e-03 3.147939e-03 -6.000000e+00 6.816090e-03 229.24 -2.00 3.88 -2.00 315.62 0.00e+00 3.109845e-04 2.738391e-04 2.997363e-05 -6.000000e+00 2.726772e-04 274.03 -2.00 20.00 -2.00 315.34 0.00e+00 1.297 0.000 302.00 328.00 3 4.1767e+00 7.9831e-03 1.8640e-02 -6.0000e+00 1.7109e-02 7.3273e-03 8.8557e-03 1.3154e-02 -6.0000e+00 1.8576e-02 -1.5859e-03 5.0761e-03 6.5141e-03 -6.0000e+00 1.0907e-02 -9.3881e-04 2.2628e-03 1.8334e-03 -6.0000e+00 4.5105e-03 1.6848e-03 -2.3680e-04 1.7794e-04 2.6408e-05 -6.0000e+00 3.4190e-04 -3.2684e-03 -3.5681e-05 12 9 1 12 1 1 999.00 22.41 0.27 -0.00327 -0.00505 1 16 1 5 0 600.521 25.39 19.99 22.41 17.17 23.9 997.73 945 -2145 -2721 -3105 -202 -1501 -4079 1891 -1341 1774 799 1941 -861 -1970 2978 -263 2602 -1301 1071 1574 566 -1180 865 2323 -1106 -33 -1354 449 1852 2967 888 213 -465 -2715 393 -1211 166 -150 -708 -484 -1229 -693 -1076 -71 -1010 -963 -672 769 -191 883 -147 -186 237 697 505 403 1368 562 987 1057 1345 925 900 -45 -40 1502 -495 966 341 351 -1609 -1754 -154 -615 554 -60 256 1593 1699 285 -437 -1615 -1642 -311 -1425 -865 -510 -261 -476 -471 73 162 389 1360 761 1194 962 661 59 133 108 -1019 730 -371 -1051 -531 -382 92 558 -141 -900 -196 -715 407 -196 113 916 687 211 -441 -831 -474 -127 86 78 -134 1019 980 449 1503 663 950 209 504 251 -732 33 -766 339 -678 -397 -562 -53 223 -554 -714 -781 -46 -335 -962 462 -362 484 221 543 -264 -668 1062 -102 1024 -540 447 670 246 -519 380 1041 -525 -16 -655 208 814 1272 396 100 -229 -1378 190 -587 84 -83 -440 -329 -889 -515 -816 -54 -771 -733 -505 563 -139 639 -109 -144 189 571 422 341 1162 479 834 891 1150 822 834 -43 -38 1385 -442 838 305 333 -1623 -1825 -159 -628 542 -56 224 1339 1445 258 -424 -1666 -1763 -341 -1630 -1024 -622 -324 -594 -578 87 182 416 1411 805 1319 1125 815 76 170 135 -1230 848 -436 -1284 -670 -494 122 754 -198 -1297 -283 -1025 561 -260 144 1149 876 278 -605 -1166 -665 -176 117 103 -173 1271 1211 569 1959 893 1299 290 710 364 -1096 50 -1184 524 -1047 -602 -839 -77 SS 20210429T123135.4Z 7789.521938 479 1 0.84 2 40.83 206.22 147.32 330.24 0.00 1 0.00 1 0 17 7.417e-03 5.958e-03 3.191e-03 1.873e-03 2.283041e-01 9.948380e-04 3.094146e-03 -6.000000e+00 4.441119e-03 229.24 -2.00 3.88 -2.00 315.56 0.00e+00 2.659896e-05 8.718585e-05 2.993874e-05 -6.000000e+00 1.777009e-04 274.04 -2.00 20.00 -2.00 315.27 0.00e+00 1.320 0.000 302.00 328.00 3 1.9371e+00 2.5770e-03 1.8690e-02 -6.0000e+00 1.1148e-02 -1.2128e-02 2.8581e-03 1.2992e-02 -6.0000e+00 1.2104e-02 1.4333e-03 1.6360e-03 6.4268e-03 -6.0000e+00 7.1074e-03 -1.2548e-03 7.2687e-04 1.8100e-03 -6.0000e+00 2.9382e-03 1.5628e-02 -4.3565e-04 5.7375e-05 2.5719e-05 -6.0000e+00 2.2283e-04 -1.2461e-03 -2.4655e-05 12 1 1 12 1 1 31.78 22.41 0.17 -0.00125 -0.00452 10 156 1 5 0 60.363 25.39 19.99 22.41 18.56 24.1 1006.25 -2340 -1072 -1105 -2561 -803 -1177 384 -164 200 -911 281 -103 19 962 -122 175 -314 365 -91 289 856 642 1307 213 823 -257 -310 -281 1095 1381 914 2057 641 -798 -277 -146 -864 -132 -728 -1035 -743 -974 -926 -673 -524 -1439 -695 -937 181 234 878 693 838 659 309 769 879 291 902 1163 1346 1430 773 216 -452 -182 276 636 682 354 -114 -289 -174 -322 -409 337 210 441 243 -44 -568 -1294 -1348 -1054 -1116 -926 -357 -539 -294 -334 95 70 902 1187 731 835 667 163 -261 -493 -462 -361 381 368 -378 -593 -612 -482 124 -126 -210 -379 -103 -160 278 732 516 414 223 -281 -428 32 -412 73 480 272 1094 1186 1074 545 371 62 336 233 153 -58 -221 -206 -662 -146 -509 -173 -436 -597 -275 -286 -674 -189 -265 89 -42 57 -257 79 -30 6 319 -46 68 -128 152 -39 128 385 290 596 98 393 -128 -153 -132 501 612 421 951 320 -412 -137 -71 -452 -75 -454 -716 -540 -718 -700 -512 -398 -1095 -514 -703 131 169 656 530 676 537 261 660 738 245 773 989 1172 1274 720 206 -435 -170 246 546 611 341 -113 -301 -183 -327 -404 311 182 371 210 -40 -544 -1330 -1440 -1148 -1256 -1081 -439 -668 -365 -404 113 79 949 1227 781 936 779 204 -330 -628 -575 -428 438 427 -458 -745 -785 -645 168 -177 -301 -554 -146 -218 368 925 658 528 295 -387 -597 45 -564 99 630 349 1365 1454 1371 724 506 85 469 328 220 -87 -341 -317 -1032 -224 -779 -255 -644 SS 20210429T133943.9Z 7789.569258 516 1 5.82 2 47.03 228.35 150.09 358.55 0.00 1 0.00 1 0 17 8.234e-03 5.610e-03 4.355e-03 1.993e-03 2.536605e-01 1.050567e-03 3.416330e-03 -6.000000e+00 4.930805e-03 229.25 -2.00 3.88 -2.00 316.33 0.00e+00 1.663891e-04 1.090512e-04 4.456671e-05 -6.000000e+00 1.972774e-04 274.04 -2.00 20.00 -2.00 316.02 0.00e+00 1.465 0.000 302.00 328.00 3 3.9260e+00 2.7422e-03 2.0758e-02 -6.0000e+00 1.2377e-02 -7.2187e-03 3.0471e-03 1.4447e-02 -6.0000e+00 1.3438e-02 1.7681e-03 1.7727e-03 7.1508e-03 -6.0000e+00 7.8909e-03 -3.5567e-03 8.2135e-04 2.0184e-03 -6.0000e+00 3.2625e-03 1.7712e-03 -4.3234e-04 6.1303e-05 2.7090e-05 -6.0000e+00 2.4737e-04 -2.1605e-03 -3.4820e-05 12 1 1 12 1 1 40.03 22.41 0.18 -0.00216 -0.00541 11 21 1 5 0 470.504 25.39 20.00 22.41 17.94 23.9 1001.41 264 -1966 -1642 -4441 -1221 -2019 198 -139 581 72 -1058 1077 -1396 849 -275 -6 -630 1246 552 752 -164 1013 64 510 966 -453 515 -668 1251 163 1636 795 742 -1046 -1243 344 -1525 -234 -942 -339 -761 -946 -1209 -522 -610 -325 -499 -1240 95 498 608 840 982 383 640 744 117 801 517 1324 1387 1129 650 577 141 160 35 457 1001 413 -154 -325 -603 -358 -188 -49 318 695 298 -411 -464 -1283 -1567 -1012 -729 -680 -641 -314 63 -386 220 156 768 778 639 879 766 469 -335 -649 -331 -310 418 222 -652 -435 -630 -562 0 -256 -85 -46 -139 -122 18 584 527 518 13 -116 -606 142 -392 189 384 317 1012 1254 882 311 141 212 285 149 -8 -97 60 128 -488 -184 -424 -461 -366 44 -361 -306 -809 -201 -322 32 -25 113 15 -220 226 -325 217 -79 -2 -202 407 187 261 -58 357 23 190 375 -182 205 -259 458 59 608 315 310 -451 -523 142 -672 -114 -521 -206 -497 -641 -837 -363 -424 -226 -343 -843 63 332 417 600 729 295 503 593 94 646 415 1053 1121 952 576 530 130 143 30 383 860 380 -150 -327 -612 -357 -180 -44 269 568 248 -365 -443 -1305 -1667 -1108 -827 -802 -782 -391 78 -474 260 175 816 807 676 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