File name: Pandora21s1_Bremen_20220322_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T101821.6Z 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_20220322_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: 20220322 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 20220322T064852.0Z 8116.283935 255 1 44.03 2 78.03 105.25 89.30 235.54 0.00 1 0.00 1 0 25 3.842e-01 6.090e-03 2.620e-01 3.909e-03 7.209310e-01 2.155160e-03 8.801257e-03 -6.000000e+00 2.274009e-01 225.58 -2.00 3.88 -2.00 321.31 0.00e+00 1.925620e-03 8.563135e-04 8.670470e-04 -6.000000e+00 9.202717e-03 269.13 -2.00 20.00 -2.00 321.01 0.00e+00 4.676 0.002 302.00 328.00 3 2.5516e+00 6.6019e-03 6.2774e-02 -6.0000e+00 5.6606e-01 1.0279e-01 9.5037e-03 4.3097e-02 -6.0000e+00 6.1570e-01 -1.0017e-01 1.1499e-02 2.4659e-02 -6.0000e+00 3.6256e-01 3.0313e-02 5.6899e-03 8.4125e-03 -6.0000e+00 1.5144e-01 1.8010e-04 -7.4281e-04 1.1955e-04 1.1365e-04 -6.0000e+00 1.1522e-02 -1.5615e-02 9.7044e-05 12 1 1 12 1 1 75.72 22.18 0.38 -0.01561 -0.02120 68 15 1 5 0 635.433 25.17 19.99 22.18 13.26 28.6 1018.02 -191516 -107885 -106383 -68840 -124583 75811 -173447 -90987 -69756 -120211 37030 -116945 -34708 -135962 -58736 -52756 -9622 -40560 -16034 -26859 -74971 27950 -45417 -23963 -23803 -9723 -34644 -30757 1222 17447 -26989 -6206 3925 8586 5071 12809 150 6021 8139 -3501 10982 -2282 4979 -4349 -6901 5051 -5470 487 -3432 2920 1281 -334 2492 -975 2514 1518 2623 2376 4628 -208 677 -650 2626 -1099 3450 2271 986 3715 585 629 665 852 1082 2074 1027 -1067 -1475 -220 1106 70 197 -675 -1623 -1755 -544 -1391 -420 191 -256 1058 762 1119 853 581 157 69 811 139 -338 -438 -75 -86 625 318 -831 -1373 -736 -581 -302 -267 -269 -56 -385 31 -64 412 690 290 -216 -525 -379 -119 35 94 194 335 1263 807 487 203 -103 354 178 221 106 -245 -51 173 -168 -313 -132 -192 66 -1527 -449 -479 -262 -648 289 -1563 -410 -290 -917 141 -1094 -180 -2332 -651 -676 -93 -604 -206 -410 -1762 262 -929 -432 -470 -179 -770 -714 21 272 -712 -162 108 248 153 358 5 230 372 -217 677 -163 350 -348 -579 385 -478 42 -325 281 139 -42 336 -149 400 257 455 415 775 -36 118 -124 551 -271 878 594 261 986 175 214 252 341 433 785 361 -346 -446 -66 358 27 89 -355 -959 -1039 -339 -929 -292 137 -184 733 500 739 543 377 112 53 717 142 -383 -513 -84 -88 578 284 -781 -1377 -775 -652 -369 -364 -409 -92 -609 51 -102 626 1030 447 -350 -892 -646 -196 55 142 283 470 1704 1110 737 349 -184 686 365 481 247 -605 -131 448 -437 -794 -316 -432 141 SS 20220322T065459.3Z 8116.288187 258 1 50.24 2 77.14 106.53 90.05 236.72 0.00 1 0.00 1 0 25 3.256e-01 5.122e-03 2.060e-01 2.772e-03 6.792563e-01 1.519925e-03 8.397937e-03 -6.000000e+00 1.926934e-01 225.58 -2.00 3.88 -2.00 321.12 0.00e+00 2.056610e-03 5.786268e-04 7.468428e-04 -6.000000e+00 7.798315e-03 269.13 -2.00 20.00 -2.00 320.81 0.00e+00 4.376 0.002 302.00 328.00 3 2.3677e+00 4.5926e-03 5.8855e-02 -6.0000e+00 4.7966e-01 7.3179e-02 6.3279e-03 4.0305e-02 -6.0000e+00 5.2174e-01 -5.7620e-02 7.4325e-03 2.2735e-02 -6.0000e+00 3.0723e-01 1.1507e-02 3.7305e-03 7.6538e-03 -6.0000e+00 1.2832e-01 2.9982e-04 -6.5019e-04 8.5421e-05 1.0196e-04 -6.0000e+00 9.7638e-03 -1.5441e-02 8.6682e-05 10 0 0 10 0 0 90.98 22.18 0.21 -0.01544 -0.02033 125 25 1 5 0 401.857 25.17 20.00 22.18 13.65 28.6 1020.24 -177378 -36011 -67310 -120596 163705 121993 -122104 57435 -60694 -24564 -66061 -93658 -60490 -52688 -69046 -25632 15779 -27759 918 -14370 -23360 -14995 -12460 -1805 -7699 -14065 5513 3943 -6476 -7588 -7684 3314 1164 -1381 -2647 -15033 3874 -10578 -2276 -360 -4646 -2442 -917 5816 -1271 -2035 -1700 -824 187 3720 -211 1641 1475 2532 1168 1041 1307 83 2734 2071 847 1707 232 1618 -334 2435 1290 1036 1761 1034 -138 1249 -1141 793 353 -385 821 -476 82 -903 64 -924 -1462 -2068 -797 -1291 -57 214 397 64 567 1257 590 1112 883 5 618 537 -486 69 -179 -201 386 659 -865 -948 -780 -498 -117 -68 -164 -256 6 -77 73 466 926 262 -333 -624 -369 -97 -95 -115 15 334 484 1057 517 279 209 47 57 322 -217 -330 121 29 -66 -250 72 -229 104 -1771 -114 -318 -903 443 330 -939 155 -356 -111 -491 -974 -566 -592 -1080 -341 161 -456 13 -241 -447 -269 -229 -32 -161 -334 111 80 -146 -186 -221 103 40 -53 -104 -672 155 -576 -139 -24 -377 -212 -83 511 -122 -202 -173 -86 20 423 -28 237 236 439 220 207 267 17 544 408 173 373 55 424 -96 687 365 302 554 372 -56 527 -495 323 133 -132 258 -151 28 -366 30 -505 -893 -1366 -553 -958 -44 170 317 50 415 856 387 733 637 4 594 557 -561 82 -204 -209 386 635 -881 -1026 -840 -571 -145 -94 -251 -422 11 -127 115 699 1364 399 -535 -1050 -624 -158 -150 -174 23 467 655 1438 772 471 391 91 116 690 -496 -801 301 73 -159 -623 171 -509 220 SS 20220322T070626.1Z 8116.296136 261 1 50.09 2 75.50 108.94 91.48 238.91 0.00 1 0.00 1 0 25 1.641e-01 4.511e-03 6.641e-02 1.497e-03 6.165703e-01 8.023112e-04 7.714433e-03 -6.000000e+00 9.709415e-02 225.58 -2.00 3.88 -2.00 320.73 0.00e+00 1.499197e-03 2.798626e-04 5.612694e-04 -6.000000e+00 3.929370e-03 269.13 -2.00 20.00 -2.00 320.43 0.00e+00 3.912 0.001 302.00 328.00 3 1.8426e+00 2.3433e-03 5.2718e-02 -6.0000e+00 2.4169e-01 4.9966e-02 3.0395e-03 3.5893e-02 -6.0000e+00 2.6290e-01 -3.0091e-02 3.3757e-03 1.9679e-02 -6.0000e+00 1.5480e-01 -4.7126e-07 1.7359e-03 6.4298e-03 -6.0000e+00 6.4660e-02 8.4076e-04 -6.2841e-04 4.5976e-05 8.0166e-05 -6.0000e+00 4.9199e-03 -1.5897e-02 6.7908e-05 10 0 0 10 0 0 42.65 22.19 0.22 -0.01590 -0.02062 270 53 1 5 0 185.487 25.17 19.99 22.19 14.64 28.6 1025.30 -32557 -41348 -76469 -47700 -72432 -37367 -70229 -34585 -73888 -46642 -31810 -43258 -22616 -15767 -13766 -18945 5260 -12441 -5454 -1949 -3643 -4524 -1076 6157 -18262 128 -12960 -395 -10435 -4218 -5210 -1885 4673 -2424 -2083 -2681 3979 -5833 2458 -4256 -514 -1124 -840 1029 -752 -169 773 -1104 -732 1518 -66 -33 1514 568 1173 922 739 -260 563 516 335 2493 1092 1224 575 1173 632 1188 838 584 -109 195 23 151 330 67 779 -214 136 -1116 -307 -1294 -1375 -1447 -1152 -847 -670 25 33 747 708 1012 1045 1451 1007 559 976 347 -251 -425 -62 -213 381 311 -807 -701 -758 -271 -328 79 -267 -169 -192 51 259 368 689 176 -78 -601 -473 -226 -234 -151 104 172 586 905 474 235 38 222 91 276 -164 -91 52 78 -336 -170 -102 -128 179 -147 -241 -690 -323 -596 -213 -596 -234 -773 -446 -283 -488 -255 -194 -208 -362 90 -283 -126 -46 -91 -108 -26 162 -617 4 -454 -12 -350 -141 -202 -84 225 -136 -116 -150 225 -397 188 -417 -55 -133 -105 130 -98 -22 104 -155 -107 231 -11 -6 311 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