File name: Pandora21s1_Bremen_20201129_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T053619.2Z 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_20201129_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: 20201129 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 20201129T092811.1Z 7638.394572 343 1 6.11 2 78.06 155.14 109.20 344.67 0.00 1 0.00 1 0 25 1.630e-01 5.689e-03 6.354e-02 2.277e-03 5.680203e-01 1.176526e-03 7.302683e-03 -6.000000e+00 9.433261e-02 220.32 -2.00 3.88 -2.00 320.19 0.00e+00 1.010504e-03 3.665461e-04 4.153791e-04 -6.000000e+00 3.905358e-03 269.19 -2.00 20.00 -2.00 319.90 0.00e+00 4.689 0.002 302.00 328.00 3 6.3868e-01 3.2995e-03 5.5946e-02 -6.0000e+00 2.3210e-01 3.2637e-02 4.0670e-03 3.2018e-02 -6.0000e+00 2.5365e-01 -1.4625e-02 4.1857e-03 1.7189e-02 -6.0000e+00 1.4992e-01 -4.6663e-03 2.2107e-03 5.5078e-03 -6.0000e+00 6.3061e-02 1.5131e-03 -9.5232e-04 6.8298e-05 7.0653e-05 -6.0000e+00 4.8876e-03 5.9816e-03 5.0566e-06 12 1 1 12 1 1 39.32 22.00 0.27 0.00598 -0.00117 59 97 1 5 0 98.820 25.17 20.00 22.00 10.28 21.1 1031.41 -14134 -51027 -40624 -74500 -43761 -96612 -55056 -75102 -30896 -42033 -34748 -22175 -31553 -11674 -10551 -9692 -5019 -1653 -4364 5029 -6048 -1045 2876 -6590 1526 -2204 -5700 -6764 -7369 3761 -2301 6673 24 4511 -2062 -114 -1193 -328 -3532 -1515 -300 -1651 808 -1051 196 -469 1338 -1040 -555 454 692 361 38 756 1681 1772 -116 -131 342 237 379 1557 2196 129 1034 1075 496 910 1301 528 -136 284 -438 180 481 523 -297 -84 231 48 -804 -1085 -1268 -1221 -987 -874 -560 -474 307 67 880 586 913 1499 761 752 662 114 -287 -529 -112 -24 492 222 -1147 -740 -1065 -286 25 -155 -3 -226 22 22 450 828 521 242 -187 -632 -784 -269 -477 63 85 273 1161 1267 555 389 124 96 140 329 -269 -210 78 -110 -500 -97 -229 -20 179 -97 -536 -410 -1038 -424 -1580 -645 -1228 -368 -611 -505 -322 -618 -236 -260 -280 -143 -50 -147 163 -226 -38 105 -289 67 -107 -291 -343 -374 181 -135 420 2 325 -157 -9 -99 -32 -435 -217 -48 -270 136 -185 35 -85 242 -198 -109 94 157 91 10 226 529 582 -40 -45 116 79 130 576 844 56 468 481 219 408 633 293 -78 171 -266 104 273 269 -143 -40 120 29 -531 -816 -988 -1016 -873 -823 -523 -457 293 62 809 505 747 1232 685 728 734 137 -374 -702 -140 -28 549 246 -1356 -878 -1338 -380 34 -234 -5 -376 37 35 686 1258 787 361 -295 -1046 -1313 -437 -752 96 130 401 1635 1811 870 648 216 178 261 647 -541 -446 170 -235 -1078 -211 -477 -42 355 SS 20201129T093927.2Z 7638.402398 346 1 48.30 2 77.39 157.73 109.57 347.39 0.00 1 0.00 1 0 25 1.163e-01 4.726e-03 2.557e-02 8.028e-04 5.417859e-01 4.219544e-04 6.934996e-03 -6.000000e+00 6.729229e-02 220.32 -2.00 3.88 -2.00 320.57 0.00e+00 1.219221e-03 1.420807e-04 4.493617e-04 -6.000000e+00 2.785658e-03 269.19 -2.00 20.00 -2.00 320.27 0.00e+00 4.456 0.002 302.00 328.00 3 2.2368e-01 1.2082e-03 5.3338e-02 -6.0000e+00 1.6557e-01 2.2557e-02 1.5217e-03 3.0821e-02 -6.0000e+00 1.8093e-01 -6.2997e-03 1.6251e-03 1.6779e-02 -6.0000e+00 1.0694e-01 -8.4915e-03 8.4692e-04 5.4818e-03 -6.0000e+00 4.4988e-02 2.9384e-03 -8.5676e-04 2.5171e-05 7.3024e-05 -6.0000e+00 3.4858e-03 5.7129e-03 3.1573e-05 10 0 0 10 0 0 30.32 22.01 0.22 0.00571 -0.00073 953 187 1 5 0 49.781 25.17 20.00 22.01 11.61 21.4 1041.16 -40061 -47138 -31857 -46266 -55468 -37974 -46542 -20358 -37675 -7227 -36562 -16797 -22912 -10601 -9156 -10740 -6210 -10446 79 -3248 -44 -5063 -253 -1378 -5215 -3013 -5639 -1726 -6183 -1436 -3613 871 -88 -141 -304 -245 -1657 -3960 -94 -2136 -483 -1011 86 -978 -43 28 -705 -127 -890 1415 644 1305 610 818 400 414 188 130 541 268 1562 1320 1518 607 1029 929 809 1088 761 692 -170 -35 -351 -25 -159 286 513 344 337 -561 -387 -1207 -1284 -1301 -928 -820 -476 -265 73 344 560 900 1226 1362 907 765 746 268 -290 -381 -191 -228 501 71 -877 -823 -683 -436 35 -64 -201 -68 -23 164 418 675 600 291 -179 -758 -699 -293 -321 -174 131 269 1115 1120 544 268 119 138 139 310 -245 -151 -26 -21 -362 -186 -52 -28 231 -319 -466 -288 -474 -588 -335 -484 -185 -461 -71 -515 -219 -354 -181 -189 -266 -165 -318 2 -104 -1 -161 -9 -48 -205 -122 -239 -69 -256 -60 -175 47 -5 -9 -20 -16 -121 -349 -9 -247 -62 -141 12 -147 -6 4 -111 -20 -149 245 123 274 141 204 106 115 53 37 151 74 442 406 521 232 410 366 311 425 323 332 -84 -18 -184 -14 -79 128 213 142 150 -291 -232 -771 -901 -975 -739 -695 -424 -243 67 305 466 696 897 1001 726 695 775 315 -350 -466 -237 -259 522 74 -969 -967 -846 -537 47 -93 -320 -115 -39 267 640 982 864 434 -283 -1264 -1177 -482 -511 -267 192 380 1509 1535 814 447 217 251 266 623 -526 -340 -61 -49 -865 -433 -115 -60 470 SS 20201129T094644.4Z 7638.407459 350 1 48.85 2 76.99 159.42 109.76 349.16 0.00 1 0.00 1 0 25 1.061e-01 5.000e-03 5.738e-02 1.743e-03 5.258734e-01 9.129555e-04 6.681003e-03 -6.000000e+00 6.137623e-02 220.32 -2.00 3.88 -2.00 320.65 0.00e+00 9.596326e-04 3.107539e-04 4.445446e-04 -6.000000e+00 2.540941e-03 269.19 -2.00 20.00 -2.00 320.33 0.00e+00 4.329 0.002 302.00 328.00 3 1.3818e+00 2.6217e-03 5.1743e-02 -6.0000e+00 1.5101e-01 -2.0807e-04 3.3084e-03 2.9834e-02 -6.0000e+00 1.6503e-01 3.5798e-02 3.5273e-03 1.6331e-02 -6.0000e+00 9.7540e-02 -2.4220e-02 1.8376e-03 5.3743e-03 -6.0000e+00 4.1030e-02 1.0552e-03 -9.0751e-04 5.5850e-05 6.9373e-05 -6.0000e+00 3.1799e-03 6.1591e-03 1.7013e-05 10 0 0 10 0 0 99.97 22.01 0.19 0.00616 -0.00066 717 141 1 5 0 67.082 25.17 20.00 22.01 12.87 21.6 1046.49 -14506 -41186 -17137 -46124 901 -73697 20678 -47522 18348 -7389 -27003 148 -20945 6082 -16834 13512 -4120 14552 -7579 -64 5392 -2781 6522 -6115 -613 -10542 2823 -5126 4439 2501 2967 3951 4548 2427 -180 5118 -6602 2740 -2979 434 200 -2072 -2533 -1007 91 -4058 2062 -1955 656 -435 1401 537 607 898 -756 1292 -347 587 311 948 -180 1447 1253 672 299 762 1433 412 1195 -274 -105 -438 -61 -326 443 780 105 1385 120 -9 -365 -1162 -1344 -1267 -922 -935 -395 -347 230 76 1087 882 1095 1512 767 1076 582 398 -593 -19 -370 -1 311 236 -1035 -896 -410 -525 208 24 26 -271 -24 87 364 745 521 503 -440 -684 -886 -251 -441 -79 70 194 1060 952 418 217 175 -50 176 201 -81 -201 55 133 -500 -39 -180 27 232 -109 -431 -163 -531 7 -1050 135 -646 159 -83 -395 2 -366 101 -402 300 -114 368 -241 -2 176 -94 225 -244 -25 -507 121 -233 182 110 147 213 276 160 -12 326 -518 219 -307 51 27 -290 -374 -150 14 -646 314 -316 107 -76 261 112 138 220 -199 348 -98 164 86 258 -51 439 425 252 118 294 535 158 493 -123 -52 -228 -32 -163 214 340 43 550 52 -4 -201 -731 -927 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