File name: Pandora21s1_Bremen_20210409_L2Fit_fout2c12d20201116p1-8.txt File generation date: 20250430T194433.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c12p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v12d20201116.txt Level 1 file used: Pandora21s1_Bremen_20210409_L1_smca1c12d20201116p1-8.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: 20210409 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 20210409T065353.4Z 7769.287424 115 1 50.83 2 70.80 103.16 72.40 137.04 0.00 1 0.00 1 0 25 1.603e-01 8.889e-03 1.779e-01 7.248e-03 4.650542e-01 3.822638e-03 6.041170e-03 -6.000000e+00 9.517977e-02 227.11 -2.00 3.88 -2.00 319.90 0.00e+00 1.196431e-03 1.043662e-03 2.708926e-04 -6.000000e+00 3.840858e-03 271.41 -2.00 20.00 -2.00 319.60 0.00e+00 3.006 0.001 302.00 328.00 3 5.3520e+00 1.0631e-02 4.0232e-02 -6.0000e+00 2.3771e-01 9.5406e-02 1.2487e-02 2.6755e-02 -6.0000e+00 2.5857e-01 -9.3567e-03 1.1369e-02 1.3865e-02 -6.0000e+00 1.5208e-01 -4.6263e-03 6.0818e-03 4.2343e-03 -6.0000e+00 6.3094e-02 6.7524e-05 -1.5170e-03 2.2985e-04 5.4183e-05 -6.0000e+00 4.8153e-03 2.5668e-03 -9.4626e-05 11 8 0 10 0 0 99.96 22.31 0.16 0.00257 -0.00883 20 4 1 5 0 2541.180 25.28 20.00 22.31 13.03 23.2 1034.70 40742 91774 44100 71404 -16792 69772 -12415 -33666 8986 61524 -4983 -18619 -14437 -24509 -23566 -9920 59202 2517 7894 12521 -9059 5907 -8403 6876 11147 8064 9357 -7562 24855 9083 8722 2220 -8206 -4340 -9393 399 -3236 2871 6746 -6864 1537 -496 -6225 -5108 -3750 2114 6344 1655 -2893 3597 244 -2846 -1200 -1483 2660 -4365 -2438 634 3027 228 3756 2107 2850 3703 1978 3046 1432 -2227 -274 -1040 301 733 -649 -400 1576 128 428 1067 1504 1358 299 -2293 -3068 -1695 -1663 158 -171 323 -7 -98 -450 1758 30 1499 1659 701 1220 1286 234 -268 213 -2135 250 -1146 -1180 -1354 -1401 -125 74 -8 188 444 308 -44 624 413 629 -341 -482 -599 -149 -190 259 -397 857 -13 483 516 252 -48 772 -227 29 -144 12 122 381 -54 -340 -362 -280 641 -400 426 702 523 661 -306 610 -227 -819 168 788 -116 -529 -458 -1010 -1135 -481 1704 128 406 645 -584 336 -563 427 712 554 641 -591 1414 613 651 199 -898 -482 -1076 42 -377 367 993 -1346 310 -109 -1508 -1253 -917 494 1434 394 -734 892 67 -877 -394 -521 942 -1713 -961 243 1116 86 1400 857 1265 1770 994 1478 679 -1095 -141 -604 189 481 -432 -256 922 69 213 514 765 781 198 -1737 -2540 -1468 -1527 152 -173 335 -7 -100 -433 1538 26 1224 1436 680 1322 1547 305 -354 269 -2541 272 -1255 -1362 -1654 -1794 -166 104 -12 307 751 520 -71 954 601 900 -506 -750 -978 -246 -310 409 -611 1251 -18 656 701 365 -76 1297 -403 53 -275 23 256 821 -120 -752 -788 -586 1275 -777 SS 20210409T070828.6Z 7769.297554 122 1 13.26 2 68.68 106.28 70.94 140.40 0.00 1 0.00 1 0 25 2.593e-02 5.167e-03 1.835e-02 1.969e-03 4.191700e-01 1.020355e-03 5.506684e-03 -6.000000e+00 1.539776e-02 227.11 -2.00 3.88 -2.00 318.89 0.00e+00 2.607738e-04 2.133200e-04 1.799410e-04 -6.000000e+00 6.212432e-04 271.41 -2.00 20.00 -2.00 318.59 0.00e+00 2.725 0.000 302.00 328.00 3 3.0327e+00 2.7584e-03 3.6273e-02 -6.0000e+00 3.8456e-02 3.3025e-02 3.1299e-03 2.3861e-02 -6.0000e+00 4.1827e-02 -7.3335e-03 2.3695e-03 1.2090e-02 -6.0000e+00 2.4601e-02 -3.6450e-03 1.2711e-03 3.5714e-03 -6.0000e+00 1.0209e-02 9.9505e-04 -8.2518e-04 6.0674e-05 4.2905e-05 -6.0000e+00 7.7866e-04 1.9078e-03 -4.2925e-05 12 1 1 12 1 1 99.98 22.31 0.18 0.00191 -0.00429 43 34 1 5 0 290.799 25.28 20.00 22.31 13.36 23.3 1036.52 -12206 -10278 -7968 -4259 -9656 -5983 3087 -11112 -4576 -13334 925 -1243 -2967 -781 -4015 426 -3631 -313 -2749 -2123 -2272 373 -561 -575 128 -2010 -869 -500 397 -1544 524 -108 1260 -531 -937 360 -2363 418 -1053 -1127 -1282 -877 -970 -765 -322 -381 -55 -594 195 137 723 629 885 1216 423 1203 345 619 471 869 1341 1201 709 812 208 510 606 587 832 133 153 -243 -90 -73 312 194 711 619 408 -244 -890 -1117 -1304 -1344 -903 -854 -383 -335 -374 336 517 691 912 1241 613 442 632 413 -580 -234 -370 -628 195 307 -719 -912 -612 -580 38 -2 -119 28 -145 -270 279 576 396 338 -141 -398 -566 -47 -150 -150 166 371 747 1363 777 432 223 239 191 584 -101 -72 81 -149 -388 -161 -278 -161 -402 -372 -345 -272 -135 -301 -188 94 -415 -179 -610 38 -57 -160 -49 -290 33 -324 -29 -276 -221 -243 39 -62 -68 16 -270 -116 -64 49 -197 71 -17 212 -95 -165 62 -455 87 -267 -335 -426 -293 -338 -271 -114 -136 -20 -212 70 51 285 270 408 596 219 608 180 322 241 462 729 667 434 537 142 336 381 367 555 96 121 -202 -75 -58 231 137 457 385 269 -174 -728 -978 -1243 -1302 -927 -934 -422 -381 -426 385 555 715 880 1172 617 474 730 533 -781 -317 -478 -779 224 352 -880 -1190 -803 -803 54 -3 -188 45 -235 -419 418 844 572 484 -214 -615 -895 -74 -236 -227 239 530 1021 1851 1130 660 354 398 330 1009 -185 -135 157 -294 -746 -314 -521 -297 -720 SS 20210409T071315.4Z 7769.300873 125 1 12.79 2 67.99 107.31 70.48 141.52 0.00 1 0.00 1 0 25 2.697e-02 5.635e-03 3.601e-02 3.876e-03 4.088990e-01 2.010816e-03 5.371006e-03 -6.000000e+00 1.602130e-02 227.11 -2.00 3.88 -2.00 318.85 0.00e+00 3.072580e-04 4.142001e-04 1.734120e-04 -6.000000e+00 6.462500e-04 271.41 -2.00 20.00 -2.00 318.55 0.00e+00 2.646 0.000 302.00 328.00 3 4.3240e+00 5.4333e-03 3.5290e-02 -6.0000e+00 4.0014e-02 4.0281e-02 6.1586e-03 2.3269e-02 -6.0000e+00 4.3517e-02 -1.3837e-03 4.6382e-03 1.1780e-02 -6.0000e+00 2.5595e-02 -6.3671e-03 2.4864e-03 3.4745e-03 -6.0000e+00 1.0624e-02 2.9700e-04 -5.7483e-04 1.2000e-04 4.2065e-05 -6.0000e+00 8.0994e-04 1.2079e-03 3.1040e-06 12 1 1 12 1 1 99.93 22.31 0.09 0.00121 -0.00311 10 9 1 5 0 1146.920 25.28 20.00 22.31 13.51 23.3 1037.10 -2003 -14430 307 -15274 7948 -1617 2582 -4019 8032 23 2399 -3211 -5993 5005 -10072 -6537 1287 2886 3162 -186 2151 -1886 -3697 -1627 -1578 2271 -377 785 -311 1230 4225 663 -620 1851 -4547 -1934 -3257 1571 12 -832 -2544 -983 -650 -759 451 -1965 -372 -1111 293 708 387 1030 279 373 -49 -16 430 623 506 94 2814 493 1524 681 537 -120 1249 151 1078 1204 22 339 374 -33 81 18 -663 75 -636 -453 -720 -889 -1028 -1585 -946 -559 -550 -477 192 259 332 1272 949 1335 371 603 540 416 -532 -613 -299 -400 288 956 -825 -763 -753 -604 198 -325 145 121 -324 -22 344 599 -86 315 33 -629 -468 -311 -128 -212 335 360 772 976 364 826 263 46 171 397 -18 -139 175 45 -86 -320 -496 -63 -328 -59 -530 10 -570 227 -49 81 -148 294 1 102 -154 -338 300 -808 -571 113 267 308 -20 226 -208 -429 -198 -204 297 -51 101 -39 156 565 102 -106 322 -823 -341 -626 334 3 -248 -849 -343 -234 -278 165 -738 -138 -414 109 270 157 446 130 183 -25 -9 231 335 269 50 1490 283 936 449 362 -79 784 95 712 870 17 277 306 -26 61 13 -434 47 -423 -332 -585 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