File name: Pandora21s1_Bremen_20210618_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T074937.1Z 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_20210618_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: 20210618 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 20210618T065859.6Z 7839.290967 232 1 49.95 2 57.63 93.47 120.49 22.27 0.00 1 0.00 1 0 17 8.860e-03 4.623e-03 5.079e-03 1.226e-03 2.713657e-01 6.464132e-04 3.579256e-03 -6.000000e+00 5.390191e-03 233.64 -2.00 3.88 -2.00 317.96 0.00e+00 1.720720e-04 9.814199e-05 7.692468e-05 -6.000000e+00 2.122701e-04 280.25 -2.00 20.00 -2.00 317.63 0.00e+00 1.861 0.000 302.00 328.00 3 4.0262e+00 1.7368e-03 2.4611e-02 -6.0000e+00 1.3676e-02 -7.7608e-03 1.9346e-03 1.5844e-02 -6.0000e+00 1.4800e-02 3.3247e-03 1.2241e-03 7.7701e-03 -6.0000e+00 8.6606e-03 -4.0374e-03 6.1402e-04 2.1815e-03 -6.0000e+00 3.5474e-03 1.0649e-03 -2.0294e-04 3.8864e-05 2.6805e-05 -6.0000e+00 2.6651e-04 1.8266e-03 3.9143e-05 11 1 0 11 8 0 99.98 22.68 0.18 0.00183 0.00030 144 28 1 5 0 346.819 25.68 20.00 22.68 30.06 25.4 1007.27 -4662 -800 -4333 -1121 -1193 790 -1145 2057 841 -1002 146 -1988 20 -928 755 -658 -840 60 696 656 179 1261 464 1009 71 -484 -482 -1038 226 -310 1362 1360 836 -875 -837 -1243 -1075 -296 -292 -854 -1382 -824 -888 -670 -759 -512 -813 -862 -402 -274 381 365 875 426 980 793 659 255 927 881 917 1190 1469 656 152 704 122 604 762 680 145 140 -175 -228 118 85 84 287 14 -422 -596 -1258 -1529 -1133 -942 -710 -194 37 -77 193 198 407 515 771 570 458 860 428 -235 -427 -475 -573 -117 -11 -747 -685 -529 -283 28 141 37 -53 -24 -53 98 436 269 244 45 -318 -316 -133 -112 -35 368 376 693 925 546 443 302 132 136 303 -16 -106 194 -15 -206 -163 -389 -330 -264 -378 -68 -389 -93 -92 58 -89 173 79 -100 15 -212 2 -123 112 -108 -146 11 129 126 35 248 94 214 16 -114 -113 -234 48 -65 296 319 211 -230 -214 -315 -292 -92 -107 -361 -642 -400 -444 -339 -385 -259 -408 -425 -195 -134 193 197 497 254 601 499 422 164 587 557 594 814 1074 508 119 524 86 415 547 536 124 125 -158 -201 98 65 59 194 10 -321 -503 -1161 -1506 -1166 -1019 -811 -232 45 -95 232 226 433 510 739 564 489 997 539 -314 -572 -613 -696 -135 -13 -927 -894 -716 -397 41 215 59 -86 -39 -81 140 592 360 335 65 -483 -494 -208 -171 -52 527 519 919 1213 745 639 455 205 215 491 -28 -186 350 -27 -382 -301 -702 -578 -453 SS 20210618T070328.8Z 7839.294083 235 1 7.51 2 56.96 94.40 120.26 23.48 0.00 1 0.00 1 0 25 7.619e-03 4.776e-03 3.787e-03 1.391e-03 2.656541e-01 7.379432e-04 3.515881e-03 -6.000000e+00 4.635214e-03 233.64 -2.00 3.88 -2.00 316.92 0.00e+00 1.865263e-04 8.695535e-05 5.633670e-05 -6.000000e+00 1.825400e-04 280.25 -2.00 20.00 -2.00 316.60 0.00e+00 1.828 0.000 302.00 328.00 3 3.0802e+00 1.9586e-03 2.4088e-02 -6.0000e+00 1.1760e-02 -2.0044e-02 2.1722e-03 1.5428e-02 -6.0000e+00 1.2727e-02 -3.7027e-04 1.2843e-03 7.5245e-03 -6.0000e+00 7.4475e-03 -1.5460e-03 6.0946e-04 2.0865e-03 -6.0000e+00 3.0505e-03 2.8812e-03 -9.6499e-05 4.2983e-05 2.6472e-05 -6.0000e+00 2.2918e-04 2.0626e-03 4.4386e-05 12 1 1 12 1 1 99.98 22.68 0.23 0.00206 0.00134 38 52 1 5 0 187.951 25.68 20.00 22.68 30.36 25.4 1008.57 -1738 -698 -1755 -3385 -1584 -2292 -657 -558 568 -418 863 99 1199 85 -477 -1047 -809 1287 -470 1121 -101 1043 502 119 216 -764 -360 -605 913 249 1629 2131 1083 -1193 -848 -139 -1018 -480 -753 -296 -891 -313 -816 -246 -823 -699 -780 -934 -581 -76 810 613 982 462 554 669 456 515 592 825 774 1256 1123 585 228 379 398 386 613 247 214 -94 -73 -235 74 -167 -144 -135 13 -104 -941 -875 -1624 -916 -903 -804 -416 -262 196 5 290 108 501 716 759 335 838 289 -134 -390 -413 -443 49 -33 -654 -406 -632 -341 170 129 -11 16 -105 -15 266 131 362 341 64 -379 -522 -83 -310 279 323 424 720 942 558 439 283 58 246 330 94 -154 52 -168 -174 -235 -303 -362 -330 -223 -97 -250 -463 -195 -273 -81 -77 85 -66 137 16 218 17 -107 -259 -211 343 -132 322 -30 307 152 38 68 -253 -118 -201 282 76 515 724 375 -434 -297 -51 -380 -207 -366 -157 -523 -193 -520 -158 -532 -449 -495 -580 -354 -46 513 395 669 333 413 486 338 381 453 629 578 995 962 509 200 314 322 304 507 218 197 -92 -72 -224 69 -148 -116 -108 10 -90 -883 -866 -1670 -989 -997 -949 -498 -324 243 6 339 121 536 735 808 375 992 364 -174 -510 -534 -531 58 -39 -804 -530 -836 -471 237 190 -16 25 -159 -21 374 172 485 453 91 -553 -763 -120 -457 394 451 564 947 1222 761 616 406 86 361 501 146 -252 86 -282 -296 -394 -493 -586 -520 SS 20210618T070738.8Z 7839.296977 238 1 51.66 2 56.34 95.27 120.03 24.60 0.00 1 0.00 1 0 25 7.362e-03 4.648e-03 1.083e-03 3.039e-04 2.609301e-01 1.604993e-04 3.458184e-03 -6.000000e+00 4.477748e-03 233.64 -2.00 3.88 -2.00 317.60 0.00e+00 1.452971e-04 2.222031e-05 6.621099e-05 -6.000000e+00 1.763646e-04 280.25 -2.00 20.00 -2.00 317.27 0.00e+00 1.798 0.000 302.00 328.00 3 1.6421e+00 4.2891e-04 2.3727e-02 -6.0000e+00 1.1361e-02 -3.0374e-02 4.7691e-04 1.5240e-02 -6.0000e+00 1.2296e-02 1.2740e-03 2.9354e-04 7.4523e-03 -6.0000e+00 7.1948e-03 -2.5004e-03 1.4452e-04 2.0764e-03 -6.0000e+00 2.9465e-03 1.2653e-02 -2.9305e-04 9.5805e-06 2.5859e-05 -6.0000e+00 2.2143e-04 2.3082e-03 9.5483e-06 10 0 0 10 0 0 99.95 22.68 0.19 0.00231 0.00011 1153 226 1 5 0 43.113 25.68 20.00 22.68 30.82 25.5 1011.62 -2135 -2235 -2225 -3051 -1525 -1628 -714 -276 -636 -1095 -898 -38 -579 -314 -587 -692 -264 -75 349 143 223 603 781 549 389 44 -237 68 659 1136 1143 1409 623 -562 -729 -503 -846 -527 -570 -853 -998 -817 -879 -773 -506 -707 -582 -685 -309 331 389 623 779 649 541 797 554 520 635 928 1104 1192 1108 595 158 308 152 520 803 464 -2 -74 -205 -188 -106 73 62 282 302 -228 -590 -1103 -1370 -1108 -887 -759 -321 -204 15 31 330 282 695 855 792 637 732 243 -265 -432 -442 -547 76 25 -674 -591 -585 -406 5 61 -6 -92 -95 -40 90 411 393 398 173 -292 -424 -121 -199 42 287 384 833 975 662 482 302 120 191 337 -24 -87 63 -12 -314 -193 -302 -376 -268 -202 -230 -233 -305 -137 -141 -65 -28 -71 -128 -106 -5 -78 -48 -103 -133 -53 -16 76 32 51 138 182 135 101 12 -64 17 158 267 281 373 178 -166 -209 -142 -258 -186 -228 -397 -512 -441 -489 -434 -284 -396 -321 -370 -164 175 215 367 486 407 352 529 375 352 424 616 752 866 870 475 127 245 112 374 605 390 -2 -69 -193 -171 -90 59 46 206 216 -181 -504 -1046 -1402 -1145 -974 -892 -381 -251 18 37 385 302 710 838 804 679 863 304 -356 -583 -568 -680 89 30 -824 -769 -799 -557 8 93 -10 -146 -146 -61 126 556 522 545 242 -439 -660 -188 -302 62 416 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