File name: Pandora21s1_Bremen_20210830_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T085117.0Z 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_20210830_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: 20210830 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 20210830T083639.7Z 7912.358793 345 1 40.86 2 55.74 126.61 50.18 251.00 0.00 1 0.00 1 0 17 2.350e-02 6.816e-03 1.549e-02 4.503e-03 2.565206e-01 2.361758e-03 3.445143e-03 -6.000000e+00 1.414653e-02 230.73 -2.00 3.88 -2.00 317.57 0.00e+00 2.116587e-04 3.266089e-04 6.389464e-05 -6.000000e+00 5.629300e-04 281.27 -2.00 20.00 -2.00 317.24 0.00e+00 1.771 0.000 302.00 328.00 3 6.1800e+00 6.2730e-03 2.3195e-02 -6.0000e+00 3.5636e-02 6.6371e-02 6.9921e-03 1.4851e-02 -6.0000e+00 3.8649e-02 1.2601e-03 4.3000e-03 7.3319e-03 -6.0000e+00 2.2668e-02 -4.9586e-03 2.1192e-03 2.0779e-03 -6.0000e+00 9.3439e-03 1.3419e-04 -3.8282e-04 1.4211e-04 2.6536e-05 -6.0000e+00 7.0615e-04 -2.2605e-03 -4.0804e-05 12 9 1 12 1 1 99.97 22.23 0.36 -0.00226 -0.00514 11 3 1 5 0 3390.958 25.28 20.00 22.23 25.73 27.0 1026.64 -6930 559 -7540 -519 -6989 -7866 -1830 14072 -8191 -96 -5362 4204 -1873 -1986 3985 -1565 3059 -2778 2433 -1940 1798 1706 567 2288 -251 1122 -3450 3105 1933 3598 -406 3017 1739 39 -3776 -1576 -2298 -2713 828 -4523 673 -867 696 -235 262 -628 -790 660 -933 2034 -1306 2313 -310 -308 1504 567 896 655 586 -783 2042 1627 1856 149 520 89 100 -129 -3 1420 -173 -496 -153 -50 -243 7 863 -681 -870 -1304 -150 -1400 -630 -705 -564 -175 -338 -391 28 374 -75 597 -484 668 -965 223 586 407 -101 -591 -197 -157 310 -323 -797 -1107 -916 319 485 802 287 153 -147 615 -345 332 -183 -484 -171 -571 61 -94 520 -144 762 -394 211 311 417 1004 440 370 177 591 41 105 22 -143 259 -530 -465 -836 -6 -717 59 -869 -53 -699 -763 -176 1286 -1018 -12 -687 509 -264 -319 682 -308 607 -606 524 -449 410 391 134 557 -66 300 -959 776 463 832 -102 786 490 12 -1110 -448 -704 -960 334 -2197 341 -467 380 -131 145 -350 -435 350 -496 1057 -727 1322 -192 -199 986 383 613 449 397 -535 1393 1179 1436 123 431 71 74 -93 -2 1160 -155 -467 -145 -46 -211 5 625 -475 -623 -1022 -129 -1325 -631 -740 -624 -204 -415 -494 36 461 -87 644 -489 644 -971 240 684 517 -136 -800 -255 -191 358 -377 -988 -1449 -1245 446 705 1217 455 247 -234 926 -491 444 -242 -656 -242 -857 93 -145 780 -211 1065 -534 274 397 551 1396 644 556 271 926 68 180 39 -257 467 -952 -813 -1426 -10 SS 20210830T084613.5Z 7912.365434 351 1 8.07 2 54.61 129.14 51.50 253.23 0.00 1 0.00 1 0 17 1.225e-02 6.810e-03 1.177e-02 5.039e-03 2.453876e-01 2.664526e-03 3.292774e-03 -6.000000e+00 7.374686e-03 230.73 -2.00 3.88 -2.00 316.50 0.00e+00 -4.721830e-05 2.864085e-04 4.569331e-05 -6.000000e+00 2.934362e-04 281.27 -2.00 20.00 -2.00 316.19 0.00e+00 1.722 0.000 302.00 328.00 3 5.4042e+00 6.9908e-03 2.2331e-02 -6.0000e+00 1.8577e-02 4.0090e-02 7.7638e-03 1.4111e-02 -6.0000e+00 2.0148e-02 -2.9661e-04 4.5383e-03 6.9390e-03 -6.0000e+00 1.1817e-02 -2.0801e-03 2.1161e-03 1.9468e-03 -6.0000e+00 4.8714e-03 3.1621e-04 -3.0370e-04 1.5575e-04 2.5790e-05 -6.0000e+00 3.6808e-04 -2.8872e-03 -3.8826e-05 12 9 1 12 1 1 999.00 22.23 0.26 -0.00289 -0.00517 2 4 1 5 0 2629.777 25.28 19.99 22.23 26.00 27.0 1028.06 -2845 437 -4878 -4018 2990 -825 -1555 2782 2685 -820 -3636 -3590 -315 5000 782 199 1172 1136 -252 1779 -178 -176 118 547 1759 -153 183 22 1115 -1139 59 -274 1560 -1497 -455 -158 -1847 21 -910 -364 -1501 -1518 -632 -479 -245 -100 -1125 -608 -1086 752 747 548 679 1130 781 -341 1390 -555 1360 1331 1684 659 165 600 504 793 -639 1166 117 977 -259 111 213 -1065 103 -996 -431 240 1699 -456 -1167 -1309 -1401 -269 -375 -1089 -380 369 -82 -425 1018 426 938 5 908 375 272 794 -1260 -194 -764 96 -1136 191 -551 -985 -549 -464 530 610 511 -368 -286 -101 434 805 320 279 -307 -9 -750 58 72 -268 524 255 409 1671 268 663 -304 2 -17 564 -318 208 394 59 -172 20 -475 -478 -601 -453 73 -866 -673 434 -119 -237 449 474 -156 -716 -727 -67 1144 207 57 347 348 -81 574 -59 -59 40 193 642 -58 69 8 384 -392 21 -103 608 -610 -179 -61 -768 10 -484 -216 -963 -1012 -428 -327 -167 -68 -760 -401 -710 486 498 383 494 850 602 -270 1100 -445 1067 1041 1338 551 146 549 463 698 -540 953 99 886 -252 111 215 -1062 98 -894 -360 192 1366 -398 -1104 -1322 -1485 -293 -426 -1297 -467 461 -103 -526 1201 477 991 5 951 416 322 996 -1664 -255 -979 117 -1346 226 -681 -1271 -727 -632 739 880 760 -557 -426 -145 592 1052 414 367 -420 -13 -1094 85 103 -377 712 336 524 2104 349 897 -427 3 -24 831 -485 326 631 95 -282 32 -761 -750 -930 SS 20210830T085604.1Z 7912.372270 354 1 48.88 2 53.48 131.80 52.88 255.46 0.00 1 0.00 1 0 25 1.337e-02 5.825e-03 1.073e-02 3.397e-03 2.420267e-01 1.781743e-03 3.237505e-03 -6.000000e+00 8.049132e-03 230.72 -2.00 3.88 -2.00 317.39 0.00e+00 4.714701e-04 2.358257e-04 5.752040e-05 -6.000000e+00 3.202271e-04 281.27 -2.00 20.00 -2.00 317.07 0.00e+00 1.676 0.000 302.00 328.00 3 6.0099e+00 4.7209e-03 2.1894e-02 -6.0000e+00 2.0276e-02 5.5361e-02 5.2580e-03 1.3963e-02 -6.0000e+00 2.1990e-02 9.5211e-04 3.1911e-03 6.8866e-03 -6.0000e+00 1.2897e-02 -3.7174e-03 1.5548e-03 1.9488e-03 -6.0000e+00 5.3172e-03 1.7960e-04 -3.4286e-04 1.0720e-04 2.4850e-05 -6.0000e+00 4.0168e-04 -2.0603e-03 2.1102e-05 10 0 0 10 0 0 99.96 22.23 0.51 -0.00206 -0.00464 18 4 1 5 0 2713.520 25.28 19.99 22.23 26.59 27.0 1030.77 1559 -8172 -1016 -3737 -614 2472 1789 -4203 -1292 -3799 -1691 1200 -3029 2064 -819 -1672 821 -11 -279 1634 3250 2400 186 -1328 162 1570 778 -2219 1313 -374 1425 2894 -550 -1194 -633 287 -1945 -747 -740 -1838 -1354 -406 -347 -704 -679 2 605 -1461 1035 -676 275 724 718 1041 362 1091 846 1023 217 1842 366 1764 1094 299 9 -694 140 175 552 -708 567 164 452 114 784 -382 -687 -177 -116 -464 -1569 -593 -1458 -716 -1010 -1168 203 -169 291 164 170 397 21 46 3 265 755 748 -95 -135 -688 -366 -508 12 -975 -685 -385 -229 402 384 576 0 784 -250 -207 -22 -163 -159 -180 -290 -221 -8 -208 71 615 -214 709 955 809 224 228 -119 493 194 33 -302 758 156 -225 -1 -392 -464 -719 167 -1046 -124 -443 -65 243 185 -508 -166 -525 -231 164 -473 348 -160 -358 181 -3 -67 395 790 589 48 -359 45 447 222 -623 337 -96 372 798 -167 -373 -190 84 -622 -271 -316 -908 -727 -227 -199 -410 -395 1 342 -822 560 -373 156 432 452 682 246 752 592 716 151 1260 260 1307 872 252 8 -563 106 128 419 -596 510 155 429 106 685 -310 -512 -125 -83 -363 -1373 -561 -1477 -755 -1126 -1381 249 -214 370 204 200 432 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