File name: Pandora132s1_Berlin_20221007_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T182229.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20221007_L1_smca1c13d20210422p1-8.txt Full location name: Institute of Space Sciences FU Berlin Short location name: Berlin Country of location: Germany Location latitude [deg]: 52.4600 Location longitude [deg]: 13.3100 Location altitude [m]: 100 Local noon date: 20221007 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: Modification of session 11, but different RefDay (April 2021). First and last pixel inside fitting window: 243 385 Nominal wavelengths inside fitting window [nm]: 305.1071 305.2480 305.3889 305.5298 305.6707 305.8116 305.9524 306.0932 306.2341 306.3749 306.5157 306.6565 306.7973 306.9380 307.0788 307.2195 307.3603 307.5010 307.6417 307.7824 307.9231 308.0638 308.2044 308.3451 308.4857 308.6264 308.7670 308.9076 309.0482 309.1888 309.3293 309.4699 309.6104 309.7510 309.8915 310.0320 310.1725 310.3130 310.4534 310.5939 310.7344 310.8748 311.0152 311.1556 311.2960 311.4364 311.5768 311.7172 311.8575 311.9979 312.1382 312.2785 312.4188 312.5591 312.6994 312.8397 312.9800 313.1202 313.2604 313.4007 313.5409 313.6811 313.8213 313.9615 314.1016 314.2418 314.3819 314.5221 314.6622 314.8023 314.9424 315.0825 315.2225 315.3626 315.5026 315.6427 315.7827 315.9227 316.0627 316.2027 316.3427 316.4827 316.6226 316.7626 316.9025 317.0424 317.1823 317.3222 317.4621 317.6020 317.7418 317.8817 318.0215 318.1613 318.3012 318.4410 318.5807 318.7205 318.8603 319.0000 319.1398 319.2795 319.4192 319.5589 319.6986 319.8383 319.9780 320.1177 320.2573 320.3969 320.5366 320.6762 320.8158 320.9554 321.0949 321.2345 321.3741 321.5136 321.6531 321.7927 321.9322 322.0717 322.2111 322.3506 322.4901 322.6295 322.7689 322.9084 323.0478 323.1872 323.3266 323.4659 323.6053 323.7447 323.8840 324.0233 324.1627 324.3020 324.4413 324.5805 324.7198 324.8591 324.9983 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20221007T060235.4Z 8315.251798 121 1 14.74 2 84.21 106.88 127.44 302.70 0.00 1 0.00 1 0 17 5.843e-01 4.984e-02 5.607e-01 5.727e-02 8.934710e-01 3.367270e-02 1.075686e-02 -6.000000e+00 3.458692e-01 225.53 -2.00 3.85 -2.00 322.18 0.00e+00 1.051627e-02 1.566682e-02 3.937670e-03 -6.000000e+00 1.731641e-02 276.63 -2.00 20.00 -2.00 321.70 0.00e+00 8.783 0.015 302.00 328.00 3 1.0229e+00 1.1929e-01 1.0680e-01 -6.0000e+00 8.6332e-01 1.3979e+00 1.4327e-01 7.2041e-02 -6.0000e+00 9.4704e-01 -1.4989e+00 1.0396e-01 2.6376e-02 -6.0000e+00 5.4867e-01 5.4915e-01 5.3832e-02 1.3609e-02 -6.0000e+00 2.2981e-01 1.2244e-05 -1.1626e-03 1.6264e-03 1.3008e-04 -6.0000e+00 1.7414e-02 -1.0902e-02 0.0000e+00 12 9 9 12 1 1 -40.13 16.16 0.70 -0.01090 -0.01964 6 5 4 8 0 2079.870 15.01 16.16 14.21 20.67 21.06 25.8 976.53 -44794 31594 900000 55155 900000 900000 900000 900000 -140584 900000 900000 -78820 900000 152163 34484 26410 -12452 900000 -38191 -78436 -91430 900000 900000 -59213 179514 106950 -23918 26313 900000 900000 -65312 -2828 -36145 -66877 900000 75069 900000 -61400 138193 -49562 156453 21369 22983 91672 -24411 109750 1881 276750 -12423 900000 28812 170655 86376 231 84957 -24012 29770 -17211 4221 -19674 8807 67731 143697 93598 -8986 76348 1423 70759 28033 43332 23613 44161 81125 23101 123437 -24292 -38906 -5501 -10522 4520 -7685 2343 -3229 6226 8813 -1188 8536 3782 5209 -10127 -7961 -22083 20224 -2694 -4120 -6145 5732 -1778 110 -1928 -2592 1945 -6121 13346 150 10392 -4253 -4215 -1921 -1750 -3486 -6708 8098 -4781 7162 9 -896 -2606 1420 2319 -1934 4096 1822 3333 -3271 3340 -719 -329 3276 1189 1472 3283 -492 -1124 -167 -1020 -2102 1323 1216 -326 -140 -780 -612 -2494 1759 900000 3070 900000 900000 900000 900000 -7826 900000 900000 -4388 900000 8470 1920 1470 -693 900000 -2126 -6351 -7866 900000 900000 -3296 9993 5954 -1331 1465 900000 900000 -4627 -157 -2561 -6430 900000 4179 900000 -5904 7693 -5518 8709 1298 1396 5103 -2347 6109 143 15406 -1194 900000 2406 9500 4808 29 5202 -4010 3149 -2778 517 -2957 1030 4901 7999 6773 -1728 6800 269 7090 4838 7236 5126 7866 9484 4372 7558 -5815 -10396 -1133 -2694 1208 -2489 783 -1242 2300 3345 -523 3542 1665 2214 -4766 -3425 -10393 6867 -1145 -2085 -3794 3713 -1431 94 -1669 -2073 1309 -4089 7429 101 6731 -3401 -3690 -1876 -1975 -4516 -9606 10163 -6677 8553 12 -1170 -3653 2012 3298 -2770 5223 2286 4015 -4089 3786 -848 -426 4808 2063 2838 6712 -1120 -2777 -437 -2803 -5937 3629 3281 -844 -334 -1737 -1339 SS 20221007T060739.1Z 8315.255313 124 1 49.36 2 83.47 107.91 128.03 303.99 0.00 1 0.00 1 0 17 7.182e-01 3.216e-02 4.268e-01 2.168e-02 8.560632e-01 1.228275e-02 1.009424e-02 -6.000000e+00 4.106460e-01 225.53 -2.00 3.85 -2.00 322.21 0.00e+00 7.898596e-03 6.559237e-03 2.417633e-03 -6.000000e+00 1.957965e-02 276.63 -2.00 20.00 -2.00 321.74 0.00e+00 7.980 0.011 302.00 328.00 3 7.4993e-01 4.5582e-02 9.5515e-02 -6.0000e+00 1.0222e+00 1.0994e+00 5.6700e-02 5.8656e-02 -6.0000e+00 1.1189e+00 -1.4702e+00 4.5190e-02 2.5509e-02 -6.0000e+00 6.5928e-01 5.9697e-01 2.2000e-02 1.0728e-02 -6.0000e+00 2.7792e-01 4.1760e-05 -1.6221e-03 6.0943e-04 1.2999e-04 -6.0000e+00 2.0095e-02 -1.0615e-02 0.0000e+00 12 8 8 10 0 0 65.87 16.16 0.63 -0.01061 -0.02280 75 16 4 8 0 657.950 15.01 16.16 14.43 20.67 21.06 25.8 977.46 900000 -86438 239506 -92509 -49578 56548 -125395 900000 -142948 900000 -99043 900000 -31011 -39595 74305 -39851 128358 -61765 900000 -44826 106169 -16798 11238 900000 -41596 273558 -65306 53357 -65633 -7018 580 29762 97970 4221 239704 15259 310192 2440 270693 74859 45728 98994 20959 224892 15825 183501 -16502 148010 32495 102614 53166 62962 60689 30247 55190 32808 99294 25868 10092 23059 28428 46139 13875 49817 10749 49387 16223 34787 19678 23172 26085 12266 23130 -2966 5345 -11012 16867 -5208 -839 8618 -9190 -1613 -5843 16553 -1831 6755 -3846 1515 5975 -1834 4609 -4360 -609 -7577 1088 -2228 -2418 -3023 -4339 -440 -4846 -2868 -5754 996 -4270 -3634 -2650 -6138 203 -3051 695 43 1513 -2862 -3193 530 -1510 -451 -1573 3828 971 2467 2481 3320 3339 2332 3006 -1373 1502 316 2434 115 109 1034 -143 547 -495 1198 -1247 -176 -166 -377 -2913 900000 -4481 5059 -4263 -1238 1194 -5779 900000 -7960 900000 -3423 900000 -774 -1369 1569 -1913 2711 -4151 900000 -2496 2243 -613 302 900000 -1917 5778 -3511 1127 -3277 -237 22 1006 2069 205 5063 580 6552 129 5718 2530 2222 2927 1372 4750 1070 3876 -1569 3126 2059 3468 3257 3857 4102 2939 4313 3257 5034 2623 1130 2192 2642 3996 1905 5366 1794 5529 2536 4776 3533 4552 5345 2928 4739 -720 1061 -2303 2565 -1056 -191 2166 -3261 -606 -2506 6014 -847 3025 -1998 758 2815 -891 1966 -1934 -260 -3777 582 -1468 -1713 -2484 -3924 -381 -4048 -2082 -4351 715 -3463 -2826 -2178 -5716 202 -3621 896 60 2104 -4066 -4384 689 -2053 -641 -2386 5602 1419 3373 3269 4226 4129 3103 3956 -1880 2333 573 4805 250 253 2566 -384 1519 -1412 3380 -3547 -468 -408 -863 -6708 SS 20221007T062024.9Z 8315.264177 127 1 50.20 2 81.64 110.53 129.50 307.32 0.00 1 0.00 1 0 17 6.249e-01 1.189e-02 2.579e-01 5.891e-03 7.415644e-01 3.250723e-03 8.852435e-03 -6.000000e+00 3.539070e-01 225.53 -2.00 3.85 -2.00 321.93 0.00e+00 8.006021e-03 1.776853e-03 1.356403e-03 -6.000000e+00 1.540958e-02 276.63 -2.00 20.00 -2.00 321.46 0.00e+00 6.465 0.006 302.00 328.00 3 5.5500e-01 1.1845e-02 7.7332e-02 -6.0000e+00 8.7618e-01 2.3242e-01 1.7286e-02 4.6169e-02 -6.0000e+00 9.5589e-01 -3.3939e-01 1.8634e-02 2.5175e-02 -6.0000e+00 5.6829e-01 1.4295e-01 8.6152e-03 1.1979e-02 -6.0000e+00 2.3882e-01 2.6622e-04 -4.5442e-04 1.7057e-04 1.5505e-04 -6.0000e+00 1.7084e-02 -1.1664e-02 0.0000e+00 12 8 8 10 0 0 2.19 16.16 0.30 -0.01166 -0.01508 224 48 4 8 0 220.120 15.01 16.16 14.99 20.67 21.06 26.1 981.98 -141401 -190032 -121049 -219906 -228671 -188087 -205177 -199748 -255505 -175893 -179923 -69268 -102933 -128292 -99188 -116761 -44704 -86952 -26373 -68933 -10813 -100958 -71378 -33853 -61674 -49394 -52296 -72558 -75946 -38589 -32638 -4339 -202 -12004 -2773 -19625 16259 -3105 14710 11546 5125 13566 4074 8112 3606 28043 -2529 18869 6291 20551 11277 8529 13325 8510 10094 5646 7175 5152 5936 1445 1076 6811 7571 10510 5226 5241 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