File name: Pandora132s1_Berlin_20240417_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T214916.2Z 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_20240417_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: 20240417 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 20240417T051013.9Z 8873.215438 176 1 21.91 2 80.98 84.23 105.02 340.04 0.00 1 0.00 1 0 25 5.715e-01 4.073e-02 4.615e-01 3.185e-02 9.984005e-01 1.927172e-02 1.184065e-02 -6.000000e+00 3.418026e-01 227.95 -2.00 3.85 -2.00 322.16 0.00e+00 6.041592e-03 9.534970e-03 2.077814e-03 -6.000000e+00 1.728002e-02 272.65 -2.00 20.00 -2.00 321.73 0.00e+00 6.048 0.005 302.00 328.00 3 2.9853e+00 6.7551e-02 8.4402e-02 -6.0000e+00 8.5821e-01 1.4420e+00 8.1968e-02 5.8895e-02 -6.0000e+00 9.4250e-01 -1.8545e+00 6.4584e-02 3.0446e-02 -6.0000e+00 5.4753e-01 7.4085e-01 3.2818e-02 1.1734e-02 -6.0000e+00 2.2618e-01 1.9057e-05 -5.7208e-04 8.8149e-04 1.9369e-04 -6.0000e+00 1.7017e-02 -3.8811e-02 0.0000e+00 12 9 9 12 1 1 96.55 17.21 0.42 -0.03881 -0.04311 6 3 2 8 0 3128.310 14.96 17.21 12.07 21.48 21.79 29.3 954.62 109994 36719 900000 -48254 900000 -93572 900000 -138574 900000 47829 900000 37136 8032 152029 -27788 900000 900000 195219 27396 69730 900000 51379 69336 13837 82640 900000 900000 -31500 900000 900000 -17489 121307 -49241 900000 -40247 900000 -6056 200899 900000 1457 56230 168961 900000 -22967 181861 27995 163095 2297 111015 109590 -10428 900000 42151 900000 1612 70304 51637 29010 87999 7377 197335 -20422 43939 31624 69088 57519 16688 1193 -8569 49291 14816 47391 5330 15554 6652 -32 23800 -18507 18910 -8436 32449 472 20031 -3461 17678 282 901 3961 -12732 11147 -11269 4954 5691 -4088 -227 -7763 -4624 -6715 5085 -7150 2202 -4140 -2480 -6486 -8174 -5742 -7083 6446 -869 3743 -2181 -79 -1210 -3095 -2266 -2080 1528 -1312 2056 -728 5512 2462 3043 1415 -2180 8056 -2037 4230 872 2433 1320 -119 925 -1806 381 -811 1753 -532 702 652 2042 -2924 -4105 3404 1136 900000 -2613 900000 -5550 900000 -12151 900000 1480 900000 1149 249 4705 -1577 900000 900000 6042 1130 2158 900000 1590 2146 545 2558 900000 900000 -1595 900000 900000 -984 3754 -4699 900000 -3510 900000 -358 6217 900000 119 2848 5229 900000 -2585 5628 1812 5047 200 3436 3700 -1291 900000 3676 900000 231 5143 4504 3020 4704 830 6107 -3332 4327 4004 6414 5988 2629 232 -2049 7489 3418 8000 1305 3107 1273 -6 3214 -4061 3352 -2397 7303 169 6481 -1375 6515 119 390 1685 -6271 4485 -4853 1882 2146 -1852 -107 -4725 -3244 -5593 4144 -6639 1726 -3032 -1599 -4299 -5839 -4235 -5626 4888 -809 3890 -2756 -107 -1703 -4399 -3091 -2768 1994 -1848 2937 -1083 7406 3200 3743 1719 -2665 8602 -2380 5051 1268 4085 2527 -252 2077 -4495 993 -2226 4748 -1475 1880 1647 4640 -6372 -8691 SS 20240417T052437.6Z 8873.225435 182 1 49.35 2 78.79 87.05 105.73 343.32 0.00 1 0.00 1 0 17 6.120e-01 1.992e-02 3.342e-01 8.129e-03 8.847703e-01 4.746063e-03 1.026380e-02 -6.000000e+00 3.594890e-01 227.95 -2.00 3.85 -2.00 322.02 0.00e+00 8.983788e-03 2.497710e-03 4.551257e-03 -6.000000e+00 1.622318e-02 272.66 -2.00 20.00 -2.00 321.60 0.00e+00 4.968 0.003 302.00 328.00 3 2.2461e+00 1.6829e-02 7.9806e-02 -6.0000e+00 8.9816e-01 4.3490e-01 2.5282e-02 7.2112e-02 -6.0000e+00 9.8158e-01 -6.4559e-01 2.8006e-02 3.0737e-02 -6.0000e+00 5.7735e-01 2.8002e-01 1.2919e-02 1.3048e-02 -6.0000e+00 2.3834e-01 1.5017e-04 -8.1484e-04 2.2875e-04 1.3729e-04 -6.0000e+00 1.7359e-02 -3.7586e-02 0.0000e+00 12 8 8 10 0 0 99.86 17.43 0.26 -0.03759 -0.04371 147 31 4 8 0 335.640 15.08 17.43 13.29 21.48 21.79 29.4 960.65 -56946 -194436 -144045 900000 -170238 900000 -328272 900000 -272009 75395 -159178 -142030 900000 -149712 900000 -132489 900000 -103547 900000 -77934 -13003 32743 -104451 900000 -87844 900000 -67574 91569 -74344 -8436 -20900 26521 67975 -25779 69799 -53773 61683 -20544 97467 41130 -696 75839 4591 73246 -2050 36550 1040 49273 26883 13390 43808 7267 48042 10764 33034 7524 29626 7656 28906 28305 -1855 24132 1297 30300 3695 16636 15136 11520 15749 8171 9381 1895 14197 2148 10931 4769 6778 -1301 885 5440 -1841 5369 -4330 745 -3559 -1023 430 -319 3353 -2941 5835 -4232 363 -3405 -2106 -1152 -2663 738 -2457 -396 -1227 480 -1428 -2303 -1425 -2689 173 -2848 621 -1268 -127 -1620 -532 -155 -848 17 -485 1001 -538 360 -885 1867 1754 1546 2288 1190 2000 630 1363 -108 1218 -66 94 587 -598 464 -349 1131 -276 106 -444 -1125 -1567 -451 -1958 -1140 900000 -1347 900000 -11100 900000 -6066 597 -1260 -1124 900000 -2370 900000 -2860 900000 -2160 900000 -1402 -134 259 -2645 900000 -2086 900000 -1337 725 -1589 -107 -380 378 753 -775 773 -2000 781 -699 1234 1074 -31 1680 218 1797 -109 1359 58 1794 1319 827 2253 610 2965 1048 2719 828 2649 836 2448 2352 -216 2425 191 3837 598 2620 2444 2042 2742 1764 2187 491 3156 498 2284 947 1261 -278 197 1409 -612 1916 -1879 327 -1728 -512 222 -169 1696 -1517 2582 -1961 159 -1661 -1177 -761 -2111 655 -2469 -392 -1139 386 -1059 -1713 -1117 -2258 150 -2754 653 -1567 -176 -2445 -810 -231 -1218 24 -683 1455 -834 563 -1361 2638 2366 2024 2876 1458 2388 819 2041 -189 2358 -139 211 1409 -1551 1243 -956 3064 -746 270 -1052 -2474 -3343 SS 20240417T061201.8Z 8873.258355 204 1 49.08 2 71.57 96.52 107.21 354.33 0.00 1 0.00 1 0 17 3.008e-01 1.443e-02 2.832e-01 1.110e-02 5.795686e-01 5.876087e-03 7.179873e-03 -6.000000e+00 1.748859e-01 227.95 -2.00 3.85 -2.00 320.55 0.00e+00 3.803589e-03 2.153417e-03 8.669542e-04 -6.000000e+00 7.623919e-03 272.66 -2.00 20.00 -2.00 320.06 0.00e+00 3.123 0.001 302.00 328.00 3 5.2981e+00 1.7413e-02 4.5659e-02 -6.0000e+00 4.3647e-01 1.4831e-01 2.1916e-02 3.3367e-02 -6.0000e+00 4.7603e-01 -7.4130e-02 2.1558e-02 1.8121e-02 -6.0000e+00 2.8050e-01 2.2420e-02 1.0922e-02 7.4145e-03 -6.0000e+00 1.1689e-01 5.4396e-05 -1.6867e-04 3.2087e-04 7.5772e-05 -6.0000e+00 8.4066e-03 -3.4807e-02 0.0000e+00 12 8 8 10 0 0 99.43 17.26 0.36 -0.03481 -0.03607 13 3 1 8 0 3774.340 14.93 17.26 13.31 21.48 21.88 29.3 960.07 -54103 -68118 900000 72633 900000 -197451 900000 -38475 64211 29847 -81080 -126891 -51322 134263 11324 -29006 33164 900000 -10965 14156 62514 -15320 -43780 -21571 -9681 35273 25457 7612 4135 35533 24520 26876 -2021 4172 -21607 39882 -7739 16837 2254 -7896 32050 5059 4562 -5386 8175 -235 11798 5833 2680 -202 -3623 3475 1629 7841 -3529 1362 -508 -1518 -210 -1726 5998 1453 -370 1866 473 -1711 807 -3056 -1037 5781 823 4030 -409 6321 -100 3687 275 -372 -140 -5450 1361 -2287 -593 -1823 151 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