File name: Pandora21s1_Bremen_20220127_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T095509.9Z 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_20220127_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: 20220127 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 20220127T131936.2Z 8062.555280 369 1 50.34 2 74.79 205.07 110.23 260.05 0.00 1 0.00 1 0 25 7.183e-02 4.085e-03 2.773e-02 9.548e-04 5.433472e-01 5.025723e-04 6.952858e-03 -6.000000e+00 4.196871e-02 222.22 -2.00 3.88 -2.00 320.38 0.00e+00 1.366977e-03 1.607709e-04 4.204858e-04 -6.000000e+00 1.720312e-03 265.78 -2.00 20.00 -2.00 320.08 0.00e+00 3.740 0.001 302.00 328.00 3 1.0860e+00 1.4279e-03 4.7978e-02 -6.0000e+00 1.0370e-01 5.7854e-02 1.7623e-03 3.0899e-02 -6.0000e+00 1.1306e-01 -1.0931e-02 1.8140e-03 1.6628e-02 -6.0000e+00 6.6736e-02 -7.5682e-03 9.5437e-04 5.3458e-03 -6.0000e+00 2.8064e-02 2.3168e-03 -7.1940e-04 2.9597e-05 6.9391e-05 -6.0000e+00 2.1523e-03 -1.5331e-02 4.1796e-05 10 0 0 10 0 0 99.99 22.21 0.16 -0.01533 -0.02074 951 187 1 5 0 52.046 25.28 20.00 22.21 14.96 28.3 1038.67 -25166 -17647 -29974 -13510 -32908 3105 -40764 -6808 -34730 -6136 -13618 -12429 -7472 -13795 969 -10231 6525 -6621 5568 1160 -879 1385 2243 720 -4826 1074 -3285 1332 -3274 2980 -756 2997 1435 -1658 722 -1051 818 -2771 1028 -1715 -1742 -948 -826 -1055 -1704 -202 -1479 597 -752 988 127 682 741 477 899 139 761 -675 912 353 1316 820 1528 846 -13 490 281 815 416 933 -457 -72 -315 37 29 87 652 -202 652 -508 -156 -1024 -1218 -1326 -952 -721 -505 109 -82 514 459 919 1074 1179 973 548 895 403 -26 -421 1 -488 477 381 -586 -648 -615 -366 -166 83 -293 -215 -340 -1 165 530 546 242 136 -439 -381 -175 -192 -268 78 153 692 981 361 175 -120 53 32 225 -171 -89 152 102 -235 -190 -66 -152 178 -232 -177 -337 -138 -356 25 -496 -72 -510 -74 -188 -189 -130 -296 22 -288 175 -223 179 41 -33 52 86 30 -218 48 -158 60 -152 144 -40 179 99 -127 54 -79 65 -251 109 -222 -256 -150 -137 -181 -298 -35 -266 107 -141 192 27 159 190 132 248 40 226 -204 282 108 408 276 536 330 -5 201 112 326 179 450 -248 -41 -181 20 15 40 292 -89 304 -259 -92 -690 -905 -1055 -802 -645 -476 106 -79 485 409 757 835 908 804 512 952 461 -33 -543 1 -553 520 406 -660 -736 -736 -463 -225 124 -477 -352 -564 -2 262 796 802 366 217 -737 -651 -293 -311 -418 117 219 949 1343 534 288 -206 96 61 449 -364 -199 336 228 -533 -422 -146 -320 359 SS 20220127T132410.5Z 8062.558455 373 1 0.76 2 75.08 206.15 110.89 260.88 0.00 1 0.00 1 0 25 1.311e-01 6.966e-03 9.405e-02 4.777e-03 5.570712e-01 2.463258e-03 7.266964e-03 -6.000000e+00 7.659519e-02 222.22 -2.00 3.88 -2.00 319.45 0.00e+00 3.241242e-04 6.198081e-04 3.087969e-04 -6.000000e+00 3.141005e-03 265.78 -2.00 20.00 -2.00 319.16 0.00e+00 3.810 0.001 302.00 328.00 3 7.0946e-01 6.7336e-03 4.8808e-02 -6.0000e+00 1.8925e-01 8.1627e-02 7.8419e-03 3.1173e-02 -6.0000e+00 2.0638e-01 -5.8685e-02 6.9335e-03 1.6248e-02 -6.0000e+00 1.2181e-01 1.4791e-02 3.7552e-03 5.0038e-03 -6.0000e+00 5.1202e-02 3.1265e-03 -1.0114e-03 1.4025e-04 6.1810e-05 -6.0000e+00 3.9306e-03 -1.5302e-02 -7.7854e-05 12 9 1 12 1 1 74.68 22.21 0.27 -0.01530 -0.02290 7 134 1 5 0 72.993 25.28 20.00 22.21 15.47 28.2 1040.58 6911 -9492 -20676 -50415 -34364 -87949 6940 -57650 57352 30435 -36179 29120 -8573 6100 -28038 8251 -12739 -2028 2448 -3019 1626 1091 4132 -2358 -1400 -9947 3941 -6138 4179 -672 3631 6104 -1227 -402 -7238 3645 -7031 52 -4527 2098 -1537 -501 688 569 2599 -1480 2311 -988 2113 -1443 673 2953 1580 1081 1142 199 -1419 1465 -761 908 293 -351 1501 2102 2009 -394 758 177 923 -951 834 -408 -69 189 798 266 -1290 -890 -445 785 232 -814 -1666 -1352 -652 -490 -797 -1308 211 -211 472 99 1085 1316 1226 474 205 666 -629 -110 -411 -137 95 -50 -484 -898 -34 -633 -138 -47 -146 260 934 -60 -203 506 758 -157 218 -746 -518 61 -778 97 123 -33 1196 1088 506 71 175 -55 49 467 -638 -132 148 -170 -182 458 -243 -214 -249 74 -139 -363 -1174 -640 -2546 90 -1496 623 436 -999 501 -240 183 -1350 349 -696 -109 135 -186 98 67 258 -170 -109 -893 313 -528 318 -56 325 620 -143 -50 -952 428 -989 8 -831 429 -370 -129 184 148 708 -401 647 -275 588 -439 218 1033 582 432 484 89 -664 669 -348 402 133 -164 766 1178 1133 -225 418 99 551 -622 593 -297 -50 137 536 170 -772 -519 -276 527 173 -670 -1523 -1265 -645 -495 -852 -1398 223 -226 473 97 991 1244 1195 505 242 820 -829 -147 -529 -167 110 -59 -577 -1103 -43 -838 -195 -68 -226 413 1493 -97 -311 751 1137 -237 334 -1207 -849 97 -1210 149 181 -48 1717 1569 764 113 294 -96 86 867 -1235 -261 295 -346 -372 911 -476 -408 -468 SS 20220127T140040.9Z 8062.583807 395 1 49.69 2 77.85 214.59 116.17 267.61 0.00 1 0.00 1 0 25 2.505e-01 4.255e-03 4.895e-02 1.021e-03 6.585480e-01 5.481763e-04 8.250739e-03 -6.000000e+00 1.463542e-01 222.22 -2.00 3.88 -2.00 320.97 0.00e+00 2.325200e-03 2.048458e-04 6.825686e-04 -6.000000e+00 5.999244e-03 265.78 -2.00 20.00 -2.00 320.66 0.00e+00 4.613 0.002 302.00 328.00 3 3.6397e-01 1.6328e-03 5.9067e-02 -6.0000e+00 3.6162e-01 8.8855e-02 2.2117e-03 3.8395e-02 -6.0000e+00 3.9428e-01 -4.6144e-02 2.5704e-03 2.1594e-02 -6.0000e+00 2.3273e-01 5.1630e-03 1.3032e-03 7.2598e-03 -6.0000e+00 9.7861e-02 1.8509e-03 -8.4495e-04 3.1151e-05 9.8344e-05 -6.0000e+00 7.5058e-03 -1.5180e-02 3.5725e-05 10 0 0 10 0 0 99.36 22.22 0.19 -0.01518 -0.02153 740 145 1 5 0 67.139 25.28 20.00 22.22 16.10 28.2 1041.98 -123729 -75859 -85102 -66490 -110858 -79270 -101955 -49814 -79820 -76726 -50003 -47095 -22385 -31530 -19164 -27963 -9608 -12176 -6578 -6392 -14572 -3391 -6159 -9121 -11726 -6566 -12234 -6163 -15521 -5713 -6808 -4818 5991 -3350 2134 -4027 -1595 -4656 -373 -1928 21 -1866 -1660 151 -298 1406 489 604 -330 2034 1254 1556 2250 1993 1739 686 1041 680 460 665 1552 1754 1260 751 304 1027 964 1122 773 678 236 -66 -186 -405 -68 64 268 -354 464 -545 -589 -1061 -1790 -1394 -1123 -795 -358 31 209 498 534 748 856 997 769 338 889 497 -154 -242 -36 -324 557 171 -745 -734 -688 -214 -123 -101 -199 -271 -215 -99 120 554 652 431 123 -367 -284 -61 -202 -221 86 -4 625 933 429 102 97 -22 53 111 -185 -182 66 101 -310 -115 -20 -62 210 -907 -412 -554 -397 -893 -505 -793 -288 -643 -660 -357 -375 -174 -348 -238 -422 -152 -203 -113 -117 -301 -64 -125 -207 -298 -169 -342 -161 -447 -160 -225 -173 225 -150 91 -183 -76 -270 -25 -148 2 -179 -168 16 -32 149 54 69 -40 259 177 246 391 378 354 148 231 153 101 144 340 416 338 228 93 314 312 371 260 259 100 -30 -84 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