File name: Pandora131s1_Palau_20230830_L2Fit_fout2c8d20220731p1-8.txt File generation date: 20230831T222828.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c8p1-8 Local principal investigator: Katrin Mueller Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 131 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora131_OF_v3d20200610.txt Instrument calibration file used: Pandora131s1_CF_v8d20220731.txt Level 1 file used: Pandora131s1_Palau_20230830_L1_smca1c8d20220731p1-8.txt Full location name: Palau Atmospheric Observatory Short location name: Palau Country of location: Palau Location latitude [deg]: 7.3420 Location longitude [deg]: 134.4722 Location altitude [m]: 23 Local noon date: 20230830 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, radiometric temperature correction, matrix method stray light correction (replaced by simple method) Data caveats: OoB data based on session 7 First and last pixel inside fitting window: 229 370 Nominal wavelengths inside fitting window [nm]: 305.1357 305.2767 305.4177 305.5587 305.6997 305.8406 305.9816 306.1225 306.2634 306.4044 306.5453 306.6862 306.8270 306.9679 307.1088 307.2496 307.3905 307.5313 307.6721 307.8129 307.9537 308.0945 308.2353 308.3760 308.5168 308.6575 308.7982 308.9389 309.0796 309.2203 309.3610 309.5017 309.6423 309.7830 309.9236 310.0642 310.2048 310.3454 310.4860 310.6266 310.7672 310.9077 311.0483 311.1888 311.3293 311.4698 311.6103 311.7508 311.8913 312.0317 312.1722 312.3126 312.4530 312.5935 312.7339 312.8743 313.0146 313.1550 313.2954 313.4357 313.5761 313.7164 313.8567 313.9970 314.1373 314.2776 314.4178 314.5581 314.6983 314.8386 314.9788 315.1190 315.2592 315.3994 315.5395 315.6797 315.8199 315.9600 316.1001 316.2402 316.3804 316.5204 316.6605 316.8006 316.9407 317.0807 317.2207 317.3608 317.5008 317.6408 317.7808 317.9207 318.0607 318.2007 318.3406 318.4805 318.6205 318.7604 318.9003 319.0401 319.1800 319.3199 319.4597 319.5996 319.7394 319.8792 320.0190 320.1588 320.2986 320.4384 320.5781 320.7179 320.8576 320.9973 321.1370 321.2767 321.4164 321.5561 321.6957 321.8354 321.9750 322.1147 322.2543 322.3939 322.5335 322.6731 322.8126 322.9522 323.0917 323.2313 323.3708 323.5103 323.6498 323.7893 323.9288 324.0682 324.2077 324.3471 324.4865 324.6260 324.7654 324.9048 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-384: 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 20230829T213110.5Z 8641.896649 177 1 48.93 2 81.93 81.69 113.68 251.97 0.00 1 0.00 1 0 17 6.335e-01 1.782e-02 3.897e-01 1.290e-02 6.843716e-01 7.124229e-03 6.701391e-03 -6.000000e+00 3.607420e-01 227.86 -2.00 3.05 -2.00 321.73 0.00e+00 1.190900e-03 4.128318e-03 5.914532e-04 -6.000000e+00 1.788892e-02 294.30 -2.00 20.00 -2.00 321.10 0.00e+00 6.661 0.000 302.00 328.00 3 1.2115e+00 2.8879e-02 7.2483e-02 -6.0000e+00 8.9365e-01 2.7148e-01 4.1057e-02 3.1981e-02 -6.0000e+00 9.7074e-01 -3.0642e-01 3.7278e-02 1.6659e-02 -6.0000e+00 5.7859e-01 1.1753e-01 1.7126e-02 5.5750e-03 -6.0000e+00 2.5154e-01 1.1420e-04 3.4921e-04 3.6625e-04 6.2919e-05 -6.0000e+00 1.6823e-02 3.6202e-02 0.0000e+00 12 8 8 10 0 0 74.57 17.86 0.19 0.03620 0.03883 28 6 4 8 0 1747.180 20.00 17.86 35.32 26.00 25.90 35.3 1000.80 -86681 -250305 900000 -193968 900000 -212743 900000 -210833 -192767 -182270 900000 -50911 -79687 900000 900000 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1389 1409 1615 1155 -195 3453 1526 2988 -977 -368 40 -1218 2187 622 69 -101 -1770 -894 1095 -1643 -267 -2380 -475 787 -429 -393 1409 410 2179 -1074 -1343 -855 -700 -774 -46 241 86 -786 -1069 -35 -1031 -1183 -885 -690 -2671 -1582 -2175 -573 -707 78 14 -230 1069 95 2417 -1466 -1910 602 200 1066 2148 3108 2378 2187 1360 -1070 1029 1138 453 -810 1326 2143 729 93 -77 -2027 -2524 -1254 -2022 1841 SS 20230829T213731.8Z 8641.901062 180 1 48.96 2 80.37 81.86 115.11 251.99 0.00 1 0.00 1 0 25 3.253e-01 6.127e-03 2.504e-01 4.728e-03 6.108462e-01 2.512079e-03 6.022742e-03 -6.000000e+00 1.832739e-01 227.86 -2.00 3.05 -2.00 321.30 0.00e+00 2.506765e-03 1.292817e-03 9.494952e-04 -6.000000e+00 8.631583e-03 294.30 -2.00 20.00 -2.00 320.60 0.00e+00 5.698 0.000 302.00 328.00 3 7.6483e-01 9.2334e-03 6.2493e-02 -6.0000e+00 4.5503e-01 8.9697e-02 1.2809e-02 2.8301e-02 -6.0000e+00 4.9408e-01 -3.4034e-02 1.2296e-02 1.5355e-02 -6.0000e+00 2.9496e-01 -1.1090e-03 5.8823e-03 5.6814e-03 -6.0000e+00 1.2871e-01 4.7863e-04 1.0280e-03 1.3254e-04 6.1321e-05 -6.0000e+00 8.4527e-03 3.5805e-02 0.0000e+00 10 0 0 10 0 0 35.13 17.86 0.29 0.03581 0.04353 72 16 4 8 0 679.840 19.99 17.86 35.63 26.00 25.90 35.3 1003.00 900000 -18153 -115031 180821 -169066 24396 -168497 900000 -105223 -41754 -49644 -26862 93746 -51170 22979 -45970 26340 -19926 -15578 -24915 -17122 -11207 -12859 23324 -9605 17639 -29238 -24708 -24470 -3788 4064 -19253 -2800 -7916 -6217 -19951 11314 -3362 1130 -2946 -2086 6682 1780 -3741 3828 525 -1602 1145 937 275 3283 -1182 6012 -1237 3369 423 -641 2451 525 4992 -1077 6806 -443 3722 -362 272 1757 -1158 2356 -847 1216 -836 349 1097 -145 894 -995 2269 -2481 443 -1564 43 -2017 -1254 -1317 -247 528 -126 1556 -215 891 20 493 251 228 991 -246 914 -640 321 60 134 -563 -1377 -936 -1309 217 -268 313 -367 3 22 -167 625 -125 592 -167 2 -419 -193 -117 -24 235 91 839 364 943 196 231 -65 -75 237 -118 26 -128 -44 306 -252 -91 -324 -127 227 900000 -84 -856 833 -1918 112 -2219 900000 -1007 -222 -317 -171 432 -689 179 -815 252 -332 -265 -486 -310 -199 -255 356 -218 313 -751 -639 -668 -99 111 -780 -105 -302 -227 -913 454 -195 76 -235 -179 554 160 -361 352 51 -164 119 104 34 446 -185 956 -225 613 82 -126 456 98 914 -231 1539 -114 1045 -103 74 484 -363 832 -321 473 -330 138 396 -47 267 -303 745 -1017 207 -854 26 -1202 -793 -892 -176 384 -92 1158 -152 579 12 311 177 187 869 -250 1009 -720 334 60 122 -523 -1401 -1006 -1485 258 -327 425 -557 4 35 -256 892 -171 809 -242 3 -680 -312 -182 -36 364 135 1192 496 1326 315 392 -121 -147 485 -258 62 -316 -110 783 -652 -226 -759 -279 481 SS 20230829T214647.8Z 8641.907498 184 1 11.04 2 78.10 82.10 117.20 251.99 0.00 1 0.00 1 0 25 1.190e-01 5.867e-03 8.376e-02 3.107e-03 5.136464e-01 1.581171e-03 5.129018e-03 -6.000000e+00 6.676180e-02 227.86 -2.00 3.05 -2.00 320.29 0.00e+00 1.602064e-03 5.953172e-04 1.901181e-04 -6.000000e+00 3.110511e-03 294.30 -2.00 20.00 -2.00 319.47 0.00e+00 4.696 0.000 302.00 328.00 3 4.8459e-01 4.9334e-03 5.1706e-02 -6.0000e+00 1.6534e-01 5.0680e-02 6.2359e-03 2.3524e-02 -6.0000e+00 1.7934e-01 -1.0329e-02 5.3919e-03 1.1673e-02 -6.0000e+00 1.0754e-01 -6.9693e-03 2.7563e-03 4.3142e-03 -6.0000e+00 4.6709e-02 1.8169e-03 9.3133e-04 8.5134e-05 3.9075e-05 -6.0000e+00 3.0612e-03 3.7236e-02 0.0000e+00 12 1 1 12 1 1 94.92 17.86 0.17 0.03724 0.04423 34 34 4 8 0 315.120 20.00 17.86 36.27 26.00 25.90 35.3 1006.60 -62998 -22672 -28461 -33835 -35809 -55199 -4850 -49990 25377 -40785 15458 -17428 -18533 -12378 -20324 5986 -15673 19684 -14106 7119 -12592 -13571 926 -11116 2628 -11926 8765 -2838 9138 -6664 -3482 2177 -8529 -1127 -8343 3421 -5536 4564 490 1802 -1224 -2726 -294 -1899 1558 -1250 4147 -742 129 1673 -1216 2533 -588 2412 -1092 1683 -149 -833 852 1067 1767 389 2396 -421 2170 728 1166 960 672 614 -332 831 -657 425 -1075 565 837 -1501 322 -1073 -45 -2063 -529 -1668 -746 -421 -657 931 107 1451 722 1407 1219 241 454 -106 473 189 -112 -532 387 -292 -266 -1139 -1124 -633 -389 388 -387 48 -159 87 7 -118 611 173 459 -241 -297 -654 -184 -130 204 409 114 1231 746 845 194 -84 -45 16 96 -282 51 86 434 -335 -30 -428 -240 7 -886 -231 -302 -371 -384 -717 -47 -822 231 -688 173 -305 -413 -321 -632 171 -567 579 -575 244 -526 -592 38 -566 124 -665 384 -135 397 -388 -231 157 -741 -87 -672 267 -563 520 66 269 -202 -480 -52 -344 278 -232 741 -143 26 361 -301 659 -171 718 -350 543 -49 -269 266 342 615 155 1044 -186 951 309 495 447 343 348 -199 491 -376 222 -541 256 373 -747 174 -684 -32 -1643 -438 -1410 -671 -400 -645 900 101 1255 615 1117 973 214 436 -117 558 243 -145 -644 440 -307 -285 -1344 -1333 -784 -509 545 -575 77 -257 146 12 -176 900 257 677 -383 -497 -1104 -300 -204 309 624 167 1700 1062 1275 329 -147 -83 31 193 -581 110 191 935 -731 -66 -894 -474 13 SS 20230829T215320.5Z 8641.912043 187 1 51.16 2 76.49 82.26 118.67 251.97 0.00 1 0.00 1 0 25 5.658e-02 4.376e-03 2.707e-02 1.179e-03 4.659021e-01 5.996438e-04 4.661447e-03 -6.000000e+00 3.173539e-02 227.86 -2.00 3.05 -2.00 320.26 0.00e+00 1.483533e-03 2.162618e-04 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