File name: Pandora21s1_Bremen_20220428_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T104325.1Z 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_20220428_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: 20220428 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 20220428T062457.3Z 8153.267330 132 1 50.17 2 69.34 93.82 67.14 126.61 0.00 1 0.00 1 0 25 5.421e-02 5.552e-03 3.808e-02 2.642e-03 4.322818e-01 1.395590e-03 5.615387e-03 -6.000000e+00 3.250781e-02 229.10 -2.00 3.88 -2.00 319.57 0.00e+00 9.593616e-04 3.450435e-04 2.276198e-04 -6.000000e+00 1.298475e-03 273.87 -2.00 20.00 -2.00 319.27 0.00e+00 2.806 0.000 302.00 328.00 3 4.1831e+00 3.8535e-03 3.7687e-02 -6.0000e+00 8.1581e-02 4.9261e-02 4.4431e-03 2.4989e-02 -6.0000e+00 8.8514e-02 -4.9451e-03 3.7600e-03 1.2781e-02 -6.0000e+00 5.1983e-02 -6.2158e-03 2.0152e-03 3.8418e-03 -6.0000e+00 2.1559e-02 2.8069e-04 -5.6792e-04 8.3701e-05 4.7191e-05 -6.0000e+00 1.6273e-03 -1.6889e-02 4.3940e-05 10 0 0 10 0 0 99.98 22.28 0.21 -0.01689 -0.02116 48 9 1 5 0 1044.959 25.28 20.00 22.28 15.63 28.7 1030.72 21849 -23600 -6468 -10848 11374 -36841 -436 -2603 -16504 -14417 -6161 2028 -16025 5239 478 -932 1820 8789 -2123 -9355 -2243 -2148 7517 -7008 2964 -2896 1474 -2108 -2830 -4538 4091 385 150 205 -6182 72 -6060 -408 -726 124 -2353 -2217 525 -1172 383 -2179 1422 -1075 -298 343 2026 1636 -143 1732 212 1488 479 772 678 215 2207 1618 1175 724 985 557 436 212 1093 218 -548 203 415 130 -601 -131 186 439 -677 -264 -479 -1287 -1506 -1303 -668 -670 -689 76 8 -479 354 604 441 847 1035 1182 954 761 -270 -224 -246 -70 -12 241 -706 -794 -689 -608 182 -230 -145 -357 135 33 225 656 199 413 64 -333 -877 -170 -181 -59 293 101 1066 1285 870 428 103 -273 300 133 -234 40 -74 128 -525 -35 -270 -186 173 320 -581 -144 -247 201 -968 -9 -59 -469 -431 -178 58 -621 198 22 -50 105 508 -144 -712 -165 -160 526 -597 246 -267 132 -191 -251 -414 373 41 18 26 -811 9 -840 -62 -132 26 -572 -576 139 -323 105 -617 391 -303 -85 100 618 543 -52 661 86 618 206 332 288 91 936 736 586 392 552 306 230 111 600 134 -371 144 296 90 -395 -79 103 233 -378 -164 -336 -1013 -1286 -1175 -633 -672 -727 83 9 -513 358 569 391 733 934 1168 1051 927 -355 -299 -318 -84 -14 268 -831 -987 -893 -824 258 -349 -234 -600 225 53 345 954 285 603 98 -536 -1447 -277 -288 -91 436 145 1465 1752 1249 663 170 -474 534 246 -451 81 -153 269 -1117 -74 -551 -365 329 SS 20220428T062955.9Z 8153.270785 136 1 13.12 2 68.59 94.83 66.54 127.76 0.00 1 0.00 1 0 25 4.370e-02 6.560e-03 4.386e-02 4.365e-03 4.176160e-01 2.287940e-03 5.463147e-03 -6.000000e+00 2.621716e-02 229.10 -2.00 3.88 -2.00 318.88 0.00e+00 1.543792e-03 4.727575e-04 1.797387e-04 -6.000000e+00 1.047029e-03 273.87 -2.00 20.00 -2.00 318.59 0.00e+00 2.715 0.000 302.00 328.00 3 4.4324e+00 6.2049e-03 3.6364e-02 -6.0000e+00 6.5795e-02 5.8631e-02 7.0191e-03 2.3982e-02 -6.0000e+00 7.1376e-02 -1.9215e-02 5.3265e-03 1.2087e-02 -6.0000e+00 4.1920e-02 3.3781e-03 2.8566e-03 3.5491e-03 -6.0000e+00 1.7391e-02 2.4236e-04 -2.6797e-04 1.3466e-04 4.2347e-05 -6.0000e+00 1.3117e-03 -1.7397e-02 1.2329e-04 12 9 1 12 1 1 99.72 22.28 0.35 -0.01740 -0.01941 6 5 1 5 0 1848.748 25.28 20.00 22.28 15.86 28.7 1031.79 6094 -14778 5415 -19748 5463 -17150 19452 -15775 12475 8403 -2733 6430 -7322 6375 -12982 6988 3258 5021 -3716 -1940 -167 -4945 -644 -8069 5133 -5902 266 -3041 -2749 693 -3894 3192 -4147 3116 -1697 3869 -2816 3002 -675 -1296 -644 -2074 2747 -1679 2272 -1925 130 -663 1193 -33 701 -42 93 1138 -1174 1826 -692 1300 139 129 1418 -203 2420 359 -217 135 676 197 1009 295 266 728 388 83 -222 265 -463 1218 -609 -225 -782 -1714 -1157 -1220 -550 -1565 -411 -257 -28 382 875 782 1274 847 755 777 635 415 -221 111 -333 -808 -49 726 -264 -1327 -795 -644 -37 317 120 -612 110 -352 456 316 86 -37 159 -269 -499 -630 -174 -224 368 341 1157 1117 745 -96 753 68 -5 591 206 -113 40 336 -584 -57 -668 -13 -350 154 -511 164 -739 152 -567 481 -596 403 301 -113 260 -384 350 -1006 512 270 438 -373 -200 -18 -546 -70 -993 595 -793 34 -393 -344 85 -538 462 -709 525 -295 631 -519 602 -165 -371 -204 -707 933 -607 800 -709 47 -243 434 -13 277 -18 42 546 -598 934 -369 685 73 67 746 -115 1444 233 -146 89 425 123 654 211 205 587 316 66 -168 186 -303 760 -399 -161 -626 -1512 -1086 -1202 -564 -1700 -462 -297 -32 434 948 800 1230 803 743 825 736 523 -297 151 -441 -1012 -57 846 -322 -1704 -1054 -886 -53 475 189 -999 178 -558 688 458 123 -53 240 -421 -798 -1004 -271 -342 542 487 1596 1531 1064 -146 1200 113 -8 1027 371 -211 77 651 -1143 -109 -1265 -23 -627 SS 20220428T063405.2Z 8153.273671 139 1 5.70 2 67.97 95.69 66.05 128.73 0.00 1 0.00 1 0 25 2.561e-02 5.549e-03 1.880e-02 2.619e-03 4.078973e-01 1.371328e-03 5.375922e-03 -6.000000e+00 1.535600e-02 229.10 -2.00 3.88 -2.00 318.42 0.00e+00 4.360569e-04 2.477177e-04 1.509811e-04 -6.000000e+00 6.134630e-04 273.87 -2.00 20.00 -2.00 318.12 0.00e+00 2.643 0.000 302.00 328.00 3 2.9873e+00 3.6806e-03 3.5438e-02 -6.0000e+00 3.8537e-02 3.7122e-02 4.1328e-03 2.3380e-02 -6.0000e+00 4.1815e-02 -1.2488e-02 2.9119e-03 1.1709e-02 -6.0000e+00 2.4557e-02 -9.8726e-04 1.5455e-03 3.3968e-03 -6.0000e+00 1.0183e-02 1.1330e-03 -7.1721e-04 7.9719e-05 4.0643e-05 -6.0000e+00 7.6886e-04 -1.6727e-02 -7.6490e-07 12 1 1 12 1 1 99.85 22.30 0.19 -0.01673 -0.02212 15 28 1 5 0 344.924 25.39 20.00 22.30 16.00 28.7 1032.14 -18701 1230 -3098 710 -4343 -8717 -2772 3624 -9362 -11640 3461 -6623 -850 -2779 -2188 -1631 -934 -3646 -1465 1377 -2680 2202 2081 604 -2278 1422 37 55 -698 -612 2378 1753 444 -1156 773 -3352 -213 -795 -289 -1774 -1584 -936 -1732 -804 -756 -803 -398 -712 440 369 1701 807 728 942 989 869 566 668 820 1056 2015 1410 1351 646 243 747 -246 1021 345 1159 -545 110 -226 210 219 -162 815 -96 296 6 -795 -1374 -1530 -1325 -1291 -1051 -833 90 -284 25 134 158 341 845 733 848 837 625 48 -567 -242 -667 26 -186 -691 -620 -551 -438 -429 121 -163 91 206 130 105 289 599 358 501 -276 -285 -346 -80 -16 179 672 788 917 467 217 312 133 343 187 15 -289 -123 -181 -312 -209 -504 -266 238 -791 52 -134 31 -183 -370 -117 160 -496 -678 180 -407 -57 -224 -207 -165 -103 -440 -183 175 -366 289 281 88 -367 232 6 9 -109 -96 392 325 93 -258 166 -741 -49 -201 -87 -607 -607 -382 -743 -348 -330 -352 -174 -311 191 165 757 394 383 503 554 504 337 399 482 612 1181 888 890 464 181 538 -170 687 247 879 -445 95 -196 176 179 -126 573 -65 208 5 -690 -1289 -1505 -1330 -1378 -1150 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