File name: Pandora21s1_Bremen_20240926_L2Fit_fout2c7d20231020p1-8.txt File generation date: 20240926T232729.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c7p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v7d20231020.txt Level 1 file used: Pandora21s1_Bremen_20240926_L1_smca1c7d20231020p1-8.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: 20240926 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: 287 429 Nominal wavelengths inside fitting window [nm]: 305.1299 305.2716 305.4132 305.5548 305.6963 305.8379 305.9793 306.1208 306.2622 306.4035 306.5448 306.6861 306.8274 306.9686 307.1098 307.2510 307.3921 307.5332 307.6742 307.8153 307.9563 308.0972 308.2382 308.3791 308.5199 308.6608 308.8016 308.9424 309.0831 309.2239 309.3646 309.5053 309.6459 309.7865 309.9271 310.0677 310.2082 310.3487 310.4892 310.6297 310.7701 310.9106 311.0509 311.1913 311.3317 311.4720 311.6123 311.7525 311.8928 312.0330 312.1732 312.3134 312.4536 312.5937 312.7338 312.8739 313.0140 313.1540 313.2941 313.4341 313.5741 313.7140 313.8540 313.9939 314.1338 314.2737 314.4136 314.5534 314.6933 314.8331 314.9729 315.1127 315.2524 315.3922 315.5319 315.6716 315.8113 315.9510 316.0906 316.2303 316.3699 316.5095 316.6491 316.7886 316.9282 317.0677 317.2073 317.3468 317.4863 317.6257 317.7652 317.9046 318.0441 318.1835 318.3229 318.4623 318.6016 318.7410 318.8803 319.0196 319.1589 319.2982 319.4375 319.5768 319.7160 319.8553 319.9945 320.1337 320.2729 320.4121 320.5513 320.6904 320.8296 320.9687 321.1078 321.2469 321.3860 321.5251 321.6641 321.8032 321.9422 322.0812 322.2202 322.3592 322.4982 322.6372 322.7762 322.9151 323.0540 323.1930 323.3319 323.4708 323.6096 323.7485 323.8874 324.0262 324.1651 324.3039 324.4427 324.5815 324.7203 324.8591 324.9978 --------------------------------------------------------------------------------------- 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 20240926T085605.8Z 9035.372290 346 1 50.43 2 61.89 139.49 36.65 235.74 0.00 1 0.00 1 0 17 1.374e-02 4.944e-03 1.360e-02 2.567e-03 3.032229e-01 1.310375e-03 3.996785e-03 -6.000000e+00 8.061650e-03 226.94 -2.00 3.88 -2.00 318.46 0.00e+00 3.554845e-04 2.350934e-04 1.005199e-04 -6.000000e+00 3.287685e-04 277.91 -2.00 20.00 -2.00 318.11 0.00e+00 2.112 0.000 302.00 328.00 3 4.7701e+00 3.5083e-03 2.7172e-02 -6.0000e+00 2.0118e-02 4.0202e-02 3.9608e-03 1.7146e-02 -6.0000e+00 2.1976e-02 1.1441e-02 2.6561e-03 8.5585e-03 -6.0000e+00 1.2928e-02 -9.7052e-03 1.3724e-03 2.4530e-03 -6.0000e+00 5.2847e-03 3.7471e-04 -5.2827e-04 8.1867e-05 3.0590e-05 -6.0000e+00 4.1331e-04 -2.0887e-03 0.0000e+00 10 0 0 10 0 0 99.99 23.01 0.13 -0.00209 -0.00606 95 19 1 5 0 530.740 26.00 20.00 23.01 21.71 35.9 1000.64 -1999 -7115 4399 -1629 2776 2354 3059 822 363 109 -2741 6608 -4113 2830 -485 353 -1539 83 -222 -1186 1096 -304 -1054 -403 3055 -2149 1278 -311 1930 -1701 1220 2226 -210 -383 -1216 203 -749 -207 -1614 -2021 -1323 -1064 -776 -1596 154 -711 9 -282 317 695 1056 273 611 641 360 1330 178 1110 143 1580 683 1166 597 -595 -66 -85 629 246 465 -496 -12 126 534 137 45 301 -44 714 -254 -447 -1400 -1058 -952 -616 -181 -429 -56 -265 375 119 764 304 854 707 677 878 553 187 -696 -199 -808 30 137 -789 -1056 -679 -266 -190 550 42 388 -285 -4 7 419 512 -325 -39 -378 -321 -207 -268 -388 234 1 620 853 645 777 332 133 324 416 -30 -195 73 79 -113 -526 -16 -235 182 -345 -123 -487 269 -99 152 130 183 56 27 8 -218 523 -410 303 -60 47 -219 12 -34 -189 173 -49 -179 -72 555 -417 234 -55 326 -306 231 455 -46 -84 -260 44 -187 -61 -563 -793 -551 -459 -341 -711 68 -314 4 -121 136 307 495 138 324 354 205 767 105 640 83 910 417 764 421 -437 -47 -57 402 162 334 -395 -10 107 446 109 33 202 -28 451 -175 -346 -1207 -982 -932 -634 -197 -494 -67 -321 443 134 800 296 789 664 683 972 673 245 -941 -260 -997 35 155 -941 -1339 -897 -365 -272 825 67 634 -468 -7 11 582 689 -445 -56 -571 -503 -326 -416 -586 338 2 825 1105 861 1100 499 208 519 682 -51 -351 136 150 -217 -1009 -30 -426 319 -605 SS 20240926T100036.1Z 9035.417085 383 1 28.81 2 56.83 157.32 45.25 252.87 0.00 1 0.00 1 0 17 2.320e-02 7.584e-03 1.915e-02 5.054e-03 2.648377e-01 2.581284e-03 3.498328e-03 -6.000000e+00 1.361123e-02 226.93 -2.00 3.88 -2.00 317.87 0.00e+00 -8.058641e-04 3.932374e-04 7.301590e-05 -6.000000e+00 5.551077e-04 277.91 -2.00 20.00 -2.00 317.52 0.00e+00 1.822 0.000 302.00 328.00 3 5.3087e+00 6.8415e-03 2.3525e-02 -6.0000e+00 3.3966e-02 3.9429e-02 7.6985e-03 1.4907e-02 -6.0000e+00 3.7104e-02 1.1877e-02 4.8320e-03 7.4232e-03 -6.0000e+00 2.1828e-02 -1.0234e-02 2.4102e-03 2.1158e-03 -6.0000e+00 8.9227e-03 3.0940e-04 -4.8057e-04 1.6032e-04 2.6397e-05 -6.0000e+00 6.9784e-04 -2.0381e-03 0.0000e+00 12 9 1 12 1 1 100.00 23.02 0.27 -0.00204 -0.00565 18 6 2 5 0 1515.590 26.00 20.00 23.02 24.49 35.7 1011.77 -9295 4224 -6351 960 -667 4980 -9364 3246 -7621 -3348 3616 -10804 6513 -370 -677 -4233 2049 3393 -880 241 -14 2542 -423 4533 -1395 1157 -549 859 1663 1740 1109 -1282 2547 -4334 3579 -4240 264 -24 -1494 -815 -2318 817 -2842 731 -1480 1437 -1908 422 -849 1468 1515 678 2078 -1073 1705 687 1510 134 1618 869 1038 1763 490 944 -991 498 -791 241 -250 1650 833 -462 166 -928 -193 -490 743 -981 -39 -2338 -920 -1839 -1346 -1252 -218 94 -356 794 -633 794 36 260 708 642 1180 861 1119 -1035 101 -710 -67 -175 871 -669 -1100 -239 -460 -331 115 278 134 338 -184 128 -425 -250 302 -78 -454 -805 229 -439 773 437 327 594 314 588 824 602 -205 38 333 518 -545 370 623 -475 294 -606 -111 -355 -653 -894 378 -618 81 -54 383 -898 309 -869 -377 388 -1417 815 -56 -114 -788 375 637 -178 50 -3 524 -94 1015 -347 285 -133 194 359 382 262 -333 669 -1196 889 -1178 79 -9 -629 -380 -1168 414 -1516 378 -779 729 -977 208 -422 736 805 385 1227 -677 1078 447 983 87 1031 564 705 1274 381 749 -773 359 -553 170 -193 1376 742 -424 149 -801 -153 -356 499 -670 -28 -1928 -823 -1785 -1370 -1339 -245 111 -438 982 -780 923 40 262 674 617 1206 963 1363 -1371 135 -932 -82 -203 987 -804 -1405 -316 -634 -475 173 436 217 542 -285 186 -582 -331 402 -108 -673 -1241 353 -670 1140 622 448 778 402 768 1134 875 -310 59 525 846 -939 654 1124 -873 535 -1090 -193 -601 -1106 SS 20240926T103152.7Z 9035.438805 405 1 1.44 2 55.38 166.58 49.75 259.85 0.00 1 0.00 1 0 17 1.089e-02 6.771e-03 1.026e-02 5.029e-03 2.527961e-01 2.603101e-03 3.367077e-03 -6.000000e+00 6.390515e-03 226.93 -2.00 3.88 -2.00 316.21 0.00e+00 -9.800448e-05 2.671376e-04 4.322652e-05 -6.000000e+00 2.606268e-04 277.90 -2.00 20.00 -2.00 315.89 0.00e+00 1.755 0.000 302.00 328.00 3 3.8216e+00 6.7544e-03 2.2525e-02 -6.0000e+00 1.5947e-02 3.3540e-02 7.5573e-03 1.4148e-02 -6.0000e+00 1.7420e-02 -3.5050e-03 4.3672e-03 7.0143e-03 -6.0000e+00 1.0248e-02 4.3099e-04 1.9877e-03 1.9739e-03 -6.0000e+00 4.1893e-03 1.4971e-03 -4.2578e-04 1.5440e-04 2.6471e-05 -6.0000e+00 3.2764e-04 -2.0692e-03 0.0000e+00 12 9 1 12 1 1 999.00 23.02 0.15 -0.00207 -0.00527 2 21 1 5 0 477.140 26.00 20.00 23.02 24.56 35.8 1010.71 -1699 -1756 -2709 1101 1563 -943 -1548 -779 -4272 1888 2402 -1579 -599 403 -960 -1335 2713 -1432 -493 1295 2024 2295 2823 -1738 2354 -980 -2207 -2272 792 602 1108 1534 209 -556 -335 -1818 -244 -53 -713 -1428 -401 -535 86 -1010 -999 -273 -306 -125 -760 -271 824 958 483 1433 594 2225 144 1204 1080 2085 967 425 537 -128 -309 -107 56 290 43 532 -306 -956 -806 938 -793 -35 -554 595 -339 -729 -192 -1315 -1192 -579 -571 -1020 -556 -504 -314 661 516 374 1219 945 1087 1070 699 -1002 -889 183 -470 -317 462 -59 -472 -641 -653 -99 188 150 -52 -43 -385 -14 488 501 637 476 -566 -403 -270 -388 -299 700 542 926 709 1087 721 -20 -58 549 -359 -86 295 -225 186 -115 -232 -309 -296 -125 -516 -327 -354 -542 199 264 -163 -290 -159 -958 411 526 -378 -157 116 -304 -447 910 -511 -179 474 741 845 1067 -708 963 -414 -919 -906 300 231 445 650 92 -244 -143 -808 -117 -29 -433 -939 -273 -374 60 -717 -708 -192 -211 -85 -518 -188 589 712 373 1125 477 1791 118 973 868 1680 810 374 492 -119 -282 -93 47 249 39 511 -307 -974 -812 906 -735 -30 -461 491 -296 -683 -190 -1379 -1292 -647 -664 -1231 -685 -627 -386 784 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