File name: Pandora21s1_Bremen_20240321_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240321T233542.6Z 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_20240321_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: 20240321 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 20240321T105813.3Z 8846.457098 406 1 0.39 2 53.02 169.47 104.47 28.34 0.00 1 0.00 1 0 17 1.249e-02 6.512e-03 8.809e-03 4.266e-03 2.766154e-01 2.237637e-03 3.720933e-03 -6.000000e+00 7.422687e-03 225.60 -2.00 3.88 -2.00 316.12 0.00e+00 -2.113904e-05 2.248317e-04 4.695032e-05 -6.000000e+00 2.997197e-04 269.15 -2.00 20.00 -2.00 315.84 0.00e+00 1.658 0.000 302.00 328.00 3 2.3262e+00 5.7797e-03 2.2703e-02 -6.0000e+00 1.8479e-02 2.4989e-02 6.4302e-03 1.5406e-02 -6.0000e+00 2.0072e-02 -5.1380e-03 3.7396e-03 7.7084e-03 -6.0000e+00 1.1819e-02 -1.1600e-03 1.7398e-03 2.2232e-03 -6.0000e+00 4.9589e-03 6.9444e-03 4.2119e-04 1.2985e-04 2.9617e-05 -6.0000e+00 3.7429e-04 -4.3009e-02 1.3795e-04 12 9 1 12 1 1 999.00 22.35 0.23 -0.04301 -0.03984 2 77 1 5 0 128.108 25.47 20.00 22.35 16.95 34.9 1013.43 3197 -5304 -1104 -4409 -2674 -5758 -3364 -1008 211 -418 -1295 437 -2348 1067 -1619 1266 1093 912 1382 1182 1900 -1037 4010 -763 587 -325 -37 32 -1166 942 1234 2458 64 419 -350 169 -2030 -218 253 -857 -653 -1228 -303 -1846 -8 -696 219 709 -613 -102 -212 765 815 1159 -137 1873 151 898 278 1382 1224 1567 627 -788 395 -101 441 -739 920 289 -547 -1236 -237 80 169 447 127 232 -217 -452 -155 -1573 -1224 -939 -851 -535 18 -563 -159 -297 765 -237 806 964 583 670 311 553 -671 -578 -281 -686 22 -50 -746 -504 315 -406 498 -687 114 93 -55 -249 112 469 496 1077 617 259 -621 -147 -345 92 148 -422 725 484 1548 521 144 -117 305 90 99 -98 137 84 -309 -143 -701 -309 -356 545 -1056 -220 -880 -492 -1034 -604 -193 44 -91 -290 99 -578 283 -485 402 364 315 489 429 700 -392 1476 -300 238 -136 -15 13 -466 363 484 1007 28 190 -157 74 -930 -107 139 -525 -428 -841 -211 -1312 -6 -491 153 487 -421 -70 -148 553 611 897 -109 1502 124 735 227 1114 996 1313 552 -728 368 -92 386 -636 796 265 -533 -1252 -241 81 165 414 111 195 -183 -401 -146 -1593 -1295 -1025 -958 -624 22 -695 -197 -365 907 -271 872 1010 617 739 363 683 -869 -758 -361 -849 26 -59 -909 -636 406 -539 676 -968 165 137 -81 -357 154 620 642 1402 828 360 -888 -210 -490 128 200 -561 933 615 1987 697 200 -167 438 132 148 -150 215 134 -496 -230 -1107 -478 -541 SS 20240321T110318.8Z 8846.460634 410 1 19.64 2 52.89 171.06 104.13 29.49 0.00 1 0.00 1 0 25 8.623e-03 4.566e-03 3.934e-03 1.065e-03 2.764200e-01 5.521530e-04 3.727317e-03 -6.000000e+00 5.123931e-03 225.60 -2.00 3.88 -2.00 317.61 0.00e+00 1.859428e-04 7.925631e-05 7.371292e-05 -6.000000e+00 2.069430e-04 269.15 -2.00 20.00 -2.00 317.32 0.00e+00 1.653 0.000 302.00 328.00 3 3.0547e+00 1.4520e-03 2.2777e-02 -6.0000e+00 1.2756e-02 3.0920e-02 1.6227e-03 1.5581e-02 -6.0000e+00 1.3857e-02 3.7570e-03 1.0174e-03 7.8416e-03 -6.0000e+00 8.1595e-03 -7.1949e-03 5.1359e-04 2.2914e-03 -6.0000e+00 3.4223e-03 3.3466e-03 -9.5226e-05 3.3391e-05 2.8845e-05 -6.0000e+00 2.5847e-04 -4.1137e-02 1.3328e-04 12 1 1 12 1 1 99.99 22.35 0.12 -0.04114 -0.04185 411 213 1 5 0 45.957 25.47 20.00 22.35 17.43 35.4 1016.69 -109 -2511 -1665 -2609 1889 -1101 4670 827 1439 340 -438 3148 -1004 585 -517 -804 -1255 -92 -492 -491 626 206 363 -466 465 -373 -71 -1106 325 808 975 1199 513 -314 -926 167 -1167 -45 -665 -772 -1238 -928 -995 -952 -334 -1006 -411 -810 -318 93 518 709 587 737 549 998 540 747 594 1052 1087 1326 1435 634 -16 4 184 176 748 268 -109 -162 -102 8 -208 271 15 386 364 -3 -600 -1002 -1170 -1161 -876 -911 -414 -337 119 -139 368 288 436 775 812 527 668 669 -214 -225 -301 -449 -92 348 -385 -637 -485 -524 -50 -42 79 -90 -137 -92 -3 308 447 381 217 -151 -390 -144 -172 -199 163 130 513 1084 736 446 304 104 147 203 165 -150 -39 199 -268 -164 -292 -294 -261 -9 -249 -170 -261 172 -97 396 80 149 38 -50 357 -129 84 -86 -145 -243 -18 -103 -106 137 45 81 -109 114 -96 -19 -280 76 190 235 300 140 -90 -262 45 -335 -15 -256 -337 -607 -484 -538 -523 -183 -553 -222 -430 -165 48 275 400 353 467 363 651 361 500 407 709 742 919 1073 512 -13 3 137 130 561 215 -97 -149 -95 7 -185 220 12 272 257 -2 -504 -939 -1153 -1211 -965 -1039 -499 -423 150 -173 431 320 443 766 813 552 773 830 -280 -302 -402 -559 -110 407 -462 -819 -654 -718 -71 -64 123 -145 -219 -139 -4 427 596 516 310 -223 -604 -225 -263 -294 236 179 672 1416 962 624 440 158 228 323 267 -257 -69 353 -483 -293 -522 -506 -435 SS 20240321T111157.2Z 8846.466634 416 1 54.12 2 52.71 173.76 103.52 31.42 0.00 1 0.00 1 0 25 1.097e-02 4.796e-03 4.420e-03 1.008e-03 2.735292e-01 5.213986e-04 3.681244e-03 -6.000000e+00 6.520976e-03 225.60 -2.00 3.88 -2.00 318.11 0.00e+00 -1.179814e-06 8.410202e-05 8.201183e-05 -6.000000e+00 2.633658e-04 269.15 -2.00 20.00 -2.00 317.80 0.00e+00 1.647 0.000 302.00 328.00 3 2.8629e+00 1.3815e-03 2.2634e-02 -6.0000e+00 1.6234e-02 3.2547e-03 1.5482e-03 1.5446e-02 -6.0000e+00 1.7635e-02 2.7079e-02 1.0056e-03 7.8085e-03 -6.0000e+00 1.0384e-02 -1.7197e-02 5.1669e-04 2.3053e-03 -6.0000e+00 4.3553e-03 4.1231e-03 -7.4817e-05 3.2107e-05 2.8751e-05 -6.0000e+00 3.2894e-04 -4.0945e-02 1.3993e-04 10 0 0 10 0 0 100.00 22.35 0.12 -0.04094 -0.04151 2964 581 1 5 0 16.776 25.47 20.00 22.35 18.03 35.0 1018.05 682 -3368 -710 -797 1009 3246 1735 4983 2672 2318 1878 4906 1285 1007 -404 -773 -705 -1520 121 -1571 840 257 1609 -308 94 -91 -734 -294 828 1888 959 2349 1274 -158 -354 535 -93 -514 47 -1453 -1407 -1634 -1478 -1617 -872 -1384 -1241 -837 -779 120 220 495 676 547 140 604 508 460 742 980 1366 1090 1145 504 20 53 231 516 958 511 -99 -68 -198 9 47 510 527 816 1214 298 -106 -850 -1357 -1237 -894 -875 -512 -268 33 -117 138 464 693 1051 1214 757 749 590 -177 -404 -203 -673 104 351 -288 -617 -560 -474 -86 30 -33 -62 -277 -122 -24 463 552 352 349 -147 -516 -284 -184 -228 131 18 572 867 714 400 173 -21 -35 305 32 -10 -11 196 -267 -134 -176 -207 -90 50 -279 -60 -65 77 235 126 387 237 215 179 464 137 123 -56 -119 -116 -257 21 -287 154 48 298 -61 20 -20 -163 -63 170 370 195 508 301 -39 -87 127 -23 -142 15 -567 -598 -743 -696 -776 -416 -663 -604 -398 -363 55 105 251 364 311 84 368 316 288 457 596 838 707 802 370 15 39 160 342 648 382 -80 -58 -174 8 39 387 361 519 769 207 -83 -746 -1298 -1253 -929 -972 -601 -328 40 -142 159 502 684 975 1138 768 842 735 -234 -547 -264 -843 121 400 -347 -796 -760 -655 -124 46 -53 -105 -460 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