File name: Pandora21s1_Bremen_20210528_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T073654.3Z 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_20210528_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: 20210528 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 20210528T083508.4Z 7818.357736 342 1 7.20 2 44.74 118.39 122.48 268.83 0.00 1 0.00 1 0 25 8.426e-03 5.830e-03 5.798e-03 3.007e-03 2.326611e-01 1.601933e-03 3.101998e-03 -6.000000e+00 5.098871e-03 232.13 -2.00 3.88 -2.00 315.94 0.00e+00 2.144129e-04 1.514816e-04 3.630838e-05 -6.000000e+00 2.018762e-04 277.73 -2.00 20.00 -2.00 315.64 0.00e+00 1.406 0.000 302.00 328.00 3 4.8482e+00 4.1905e-03 1.9604e-02 -6.0000e+00 1.2888e-02 3.7201e-02 4.6447e-03 1.3365e-02 -6.0000e+00 1.3964e-02 -2.4442e-03 2.6686e-03 6.5464e-03 -6.0000e+00 8.1809e-03 -5.5102e-04 1.2025e-03 1.8191e-03 -6.0000e+00 3.3619e-03 7.5947e-04 -1.2280e-04 9.2153e-05 2.4772e-05 -6.0000e+00 2.5334e-04 -2.5658e-04 3.2604e-06 12 1 1 12 1 1 95.83 22.31 0.25 -0.00026 -0.00118 4 7 1 5 0 1395.657 25.28 20.00 22.31 19.90 24.4 1017.79 2031 -681 -1473 -1141 185 1017 -2950 2399 1393 -10 -1696 1832 -2016 54 -456 -527 -844 -985 1813 -426 -85 -18 453 -757 833 690 -2137 36 751 453 632 1944 1165 -799 -1029 325 -165 585 -334 -1146 -817 -692 -1168 287 -250 -1439 -515 -1094 -386 413 784 216 354 395 1121 1077 1103 437 618 588 1916 483 925 1090 610 -120 225 -71 711 332 -205 25 -18 -404 -69 -50 -410 725 388 -507 -605 -1060 -1387 -1571 -1127 -671 -593 25 -35 -173 300 -159 230 739 720 517 1085 105 -255 -563 -564 -295 129 100 -897 -413 -307 135 85 -9 -400 -140 251 281 -284 586 462 391 -10 -546 -234 -105 -237 708 290 441 623 730 955 460 109 -98 120 521 68 57 -80 30 -143 -79 -183 -708 -727 407 -149 -329 -242 36 189 -590 501 318 -2 -415 446 -548 16 -149 -184 -307 -369 683 -167 -34 -7 182 -318 360 305 -960 15 304 181 258 830 525 -371 -465 144 -77 304 -197 -752 -571 -499 -861 211 -184 -1067 -375 -785 -272 289 563 162 276 317 914 891 922 366 514 487 1603 424 848 1033 580 -110 197 -61 625 312 -204 26 -19 -411 -68 -46 -355 600 326 -456 -583 -1087 -1487 -1743 -1294 -799 -731 31 -44 -214 356 -180 246 766 760 575 1275 131 -331 -733 -714 -356 150 117 -1103 -525 -402 180 117 -13 -585 -206 363 392 -380 750 585 504 -13 -759 -332 -149 -332 966 386 569 782 908 1213 608 148 -136 169 743 100 87 -124 48 -225 -123 -281 -1071 -1085 SS 20210528T085634.9Z 7818.372626 357 1 2.01 2 42.00 124.45 125.54 272.96 0.00 1 0.00 1 0 17 7.475e-03 5.703e-03 4.590e-03 2.815e-03 2.186731e-01 1.507239e-03 2.941683e-03 -6.000000e+00 4.521858e-03 232.13 -2.00 3.88 -2.00 315.40 0.00e+00 -1.024544e-04 1.268514e-04 2.741727e-05 -6.000000e+00 1.790965e-04 277.73 -2.00 20.00 -2.00 315.11 0.00e+00 1.344 0.000 302.00 328.00 3 3.5853e+00 3.9232e-03 1.8600e-02 -6.0000e+00 1.1430e-02 2.1616e-02 4.3422e-03 1.2594e-02 -6.0000e+00 1.2385e-02 -9.9492e-04 2.4758e-03 6.1678e-03 -6.0000e+00 7.2560e-03 -6.8675e-04 1.0842e-03 1.7100e-03 -6.0000e+00 2.9804e-03 2.9535e-03 -5.9985e-04 8.5912e-05 2.4477e-05 -6.0000e+00 2.2478e-04 2.6063e-03 -1.1127e-05 12 1 1 12 9 1 84.82 22.32 0.12 0.00261 -0.00190 4 27 1 5 0 365.596 25.28 20.00 22.32 20.73 24.4 1021.35 -2138 -985 -2197 -928 -1125 -553 -1403 -135 -521 -1037 774 -103 1089 -477 337 -621 -188 -182 670 1275 311 1382 -637 1088 481 404 150 -103 1984 1045 1930 1448 1192 -900 -611 -50 -368 627 -739 -446 -1354 -631 -1308 -1118 -1341 -581 -560 -635 -166 207 985 265 403 506 93 768 704 221 673 1645 712 1013 604 682 -362 121 67 384 1162 638 313 -107 -274 -109 58 -336 176 514 365 -266 -660 -1222 -928 -1090 -1250 -1106 -666 -452 -537 -31 194 170 777 674 841 264 824 586 -275 -702 -226 -415 -59 401 -459 -78 -688 -173 -3 -77 38 105 -139 -265 201 183 803 111 3 -327 -400 30 -119 401 429 498 734 977 596 501 309 -73 245 258 104 -170 149 0 -277 -216 -274 -512 -693 -573 -277 -630 -252 -285 -135 -357 -37 -153 -317 234 -32 357 -173 131 -258 -80 -79 297 575 143 632 -299 521 239 205 76 -50 918 478 896 705 605 -469 -310 -25 -193 360 -476 -313 -1012 -484 -1022 -878 -1053 -453 -432 -480 -124 154 745 208 327 422 79 660 610 192 579 1406 621 913 569 661 -353 113 60 337 1043 610 315 -111 -285 -112 57 -316 156 438 315 -243 -644 -1262 -994 -1204 -1430 -1312 -813 -563 -670 -38 229 191 830 702 888 292 962 720 -350 -898 -281 -496 -69 468 -558 -98 -888 -228 -5 -107 54 150 -197 -363 263 231 998 141 4 -444 -555 42 -163 538 561 633 908 1195 747 649 412 -98 335 358 149 -249 223 1 -423 -328 -410 -754 -1008 SS 20210528T090620.7Z 7818.379406 360 1 49.93 2 40.81 127.38 126.93 274.89 0.00 1 0.00 1 0 17 6.777e-03 4.817e-03 1.462e-03 5.988e-04 2.145454e-01 3.163675e-04 2.873550e-03 -6.000000e+00 4.100894e-03 232.13 -2.00 3.88 -2.00 316.76 0.00e+00 4.874631e-05 3.574164e-05 4.183873e-05 -6.000000e+00 1.623613e-04 277.74 -2.00 20.00 -2.00 316.44 0.00e+00 1.320 0.000 302.00 328.00 3 3.3111e+00 8.3466e-04 1.8298e-02 -6.0000e+00 1.0366e-02 2.1926e-02 9.2677e-04 1.2416e-02 -6.0000e+00 1.1231e-02 2.2826e-03 5.4407e-04 6.0922e-03 -6.0000e+00 6.5797e-03 -3.5194e-03 2.5452e-04 1.7030e-03 -6.0000e+00 2.7039e-03 4.0036e-03 -1.5933e-04 1.8671e-05 2.2373e-05 -6.0000e+00 2.0375e-04 3.9891e-04 2.7733e-05 10 0 0 10 0 0 99.99 22.32 0.18 0.00040 -0.00080 485 95 1 5 0 102.936 25.28 19.99 22.32 21.35 24.4 1025.64 -949 -2513 -1254 -2243 -598 -670 -521 689 -867 463 -592 874 -651 274 -578 -690 -361 -295 576 -284 1047 362 1340 136 516 3 -354 231 475 1490 684 1766 272 -352 -740 -43 -647 -373 -231 -1090 -770 -954 -722 -962 -423 -815 -591 -753 -418 447 322 810 716 873 445 957 711 541 699 777 1311 1083 1223 333 123 105 139 492 705 353 -223 -33 -320 -109 -218 134 13 398 275 -222 -517 -1192 -1213 -1213 -851 -813 -384 -348 -117 -125 205 121 434 1000 770 753 689 356 -263 -383 -332 -532 204 80 -479 -550 -414 -356 64 73 30 -52 -169 -81 8 542 279 493 102 -188 -398 -118 -122 12 472 262 922 898 624 405 230 99 117 403 -50 -84 32 32 -331 -127 -324 -441 -285 -144 -418 -208 -352 -87 -94 -76 110 -154 85 -109 163 -134 63 -143 -185 -101 -85 169 -87 320 112 415 44 176 1 -124 80 153 462 220 598 99 -131 -266 -15 -245 -163 -114 -626 -482 -603 -467 -630 -275 -527 -389 -481 -259 274 205 544 507 619 326 713 538 409 521 576 992 872 1055 305 112 90 110 390 559 310 -216 -32 -315 -108 -203 113 11 296 208 -185 -463 -1181 -1238 -1304 -969 -990 -474 -445 -150 -155 247 134 452 988 782 829 804 440 -348 -507 -418 -647 234 93 -596 -702 -553 -496 93 108 46 -81 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