File name: Pandora132s1_Berlin_20230727_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T202247.9Z 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_20230727_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: 20230727 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 20230727T040918.8Z 8608.173134 51 1 49.81 2 84.08 65.81 141.68 319.41 0.00 1 0.00 1 0 25 5.262e-01 4.375e-02 5.511e-01 4.824e-02 1.077763e+00 2.830903e-02 1.247868e-02 -6.000000e+00 3.161312e-01 233.44 -2.00 3.85 -2.00 322.38 0.00e+00 -2.723847e-02 1.415112e-02 3.864772e-03 -6.000000e+00 1.428673e-02 282.76 -2.00 20.00 -2.00 321.87 0.00e+00 8.622 0.014 302.00 328.00 3 9.5742e-01 1.0921e-01 1.1508e-01 -6.0000e+00 8.0095e-01 1.7436e+00 1.3380e-01 9.2351e-02 -6.0000e+00 8.7254e-01 -2.0655e+00 8.6836e-02 3.1847e-02 -6.0000e+00 5.1139e-01 7.5250e-01 4.3884e-02 2.0181e-02 -6.0000e+00 2.1023e-01 1.3198e-05 1.5012e-03 1.2263e-03 2.4131e-04 -6.0000e+00 1.4961e-02 -1.3357e-02 0.0000e+00 12 9 9 12 4 4 19.00 5.63 0.78 -0.01336 -0.00208 33 7 4 8 0 1509.280 14.98 5.63 18.98 21.17 21.48 28.1 964.73 -43350 -55637 34482 36145 -37230 18273 900000 -5907 -70622 900000 -69559 -76568 900000 900000 -65762 237888 128424 29328 900000 900000 -28362 9529 900000 -32238 48129 76746 24348 86709 -82450 -91038 -4455 76786 24969 900000 53179 900000 240948 66897 34773 -18404 168547 76784 17627 152511 171813 900000 -22413 53890 -10092 -949 -18044 90820 20024 -27473 -4729 36884 65463 -2996 86274 2056 49310 7243 -13769 33808 62834 68271 -775 49116 -3803 23663 6304 30831 22276 8558 61213 -19885 -3365 -17244 30163 15111 10657 22940 6140 12492 -8542 11503 -1182 -1442 -8340 2996 4766 -1990 -923 -15069 18073 -4824 6456 -1688 3597 1991 -4146 -14967 -4937 -3312 -7773 4614 -1325 381 2772 -10003 1107 294 4069 -4618 -386 -3941 475 -6857 -498 3213 1840 4231 1256 6930 5167 2334 3819 -2692 3023 -1228 -1354 -1880 530 -1148 3180 2467 10 1286 -1137 -1356 -551 -693 -2461 -2205 -3048 1619 1697 -1748 858 900000 -277 -4522 900000 -4751 -5883 900000 900000 -5614 11170 6030 1377 900000 900000 -1453 447 900000 -2202 2260 3603 1143 4071 -6687 -8160 -209 3605 1172 900000 2497 900000 11313 3141 1781 -1885 7914 3605 1407 7161 8067 900000 -1999 2530 -853 -80 -2033 4264 1880 -4515 -666 3637 4918 -422 4456 222 3241 782 -2069 3492 5015 5129 -120 5074 -768 4111 1391 5356 3975 1567 5748 -3735 -521 -3320 4249 2980 2602 5709 1989 4047 -3610 4159 -499 -609 -3642 1097 1611 -701 -334 -7075 7213 -2877 4031 -1189 2579 1428 -3173 -11244 -3106 -2099 -5511 3055 -996 311 2564 -11230 1271 368 5072 -6228 -486 -5080 602 -9834 -700 4334 2396 5562 1639 8363 6187 2795 4572 -3881 4912 -2211 -2745 -4188 1255 -3013 8593 6982 31 3733 -3287 -3663 -1344 -1565 -5608 SS 20230727T041520.5Z 8608.177321 54 1 49.00 2 83.24 66.97 142.26 321.41 0.00 1 0.00 1 0 25 6.047e-01 3.071e-02 4.869e-01 2.479e-02 1.037652e+00 1.500552e-02 1.230166e-02 -6.000000e+00 3.627294e-01 233.44 -2.00 3.85 -2.00 322.48 0.00e+00 7.131533e-03 8.807427e-03 1.972656e-03 -6.000000e+00 1.618729e-02 282.76 -2.00 20.00 -2.00 322.03 0.00e+00 7.744 0.010 302.00 328.00 3 8.5054e-01 6.1480e-02 1.0243e-01 -6.0000e+00 9.1666e-01 1.5344e+00 7.6687e-02 7.2257e-02 -6.0000e+00 9.9855e-01 -1.8983e+00 5.6916e-02 3.1386e-02 -6.0000e+00 5.8992e-01 7.3580e-01 2.7376e-02 1.3492e-02 -6.0000e+00 2.4281e-01 3.2371e-05 -1.7931e-03 6.5247e-04 1.8348e-04 -6.0000e+00 1.7493e-02 -1.3787e-02 0.0000e+00 12 9 9 12 4 4 18.11 5.76 0.62 -0.01379 -0.02726 57 12 4 8 0 859.550 15.01 5.76 19.34 21.17 21.48 28.0 965.84 -3255 -81312 900000 -65964 81120 -131485 -5787 -46409 171711 -96070 -40789 19016 -73314 900000 8678 900000 -13971 900000 -66855 12482 40884 -37643 69000 900000 109536 -60260 900000 -88698 -20813 -31586 -22371 169833 50909 900000 142248 900000 -34023 900000 44652 210638 327321 46886 151374 -1175 900000 -4097 56217 48106 48414 41319 23362 158946 5876 150625 25901 108477 6181 90482 35379 44982 85246 -8240 46825 17055 27234 8035 77327 20098 30470 46631 14233 47328 8544 34986 -3404 9799 2849 -1825 -10659 6285 14338 2666 18664 -12367 3930 -706 5387 7737 4958 8759 -18251 6833 -9220 -760 -3133 -5812 -3544 -4387 -368 -2481 2053 -5667 4216 -7222 -5075 -1324 -5129 2821 -2344 1923 -2195 -2482 -1624 -1181 -1167 -4220 118 -103 2440 1312 6405 724 1841 1207 2146 2739 -1235 2354 1039 248 339 660 -593 -210 238 -371 1339 518 1248 -1844 -161 -1172 -1737 -79 -4102 900000 -2315 1957 -6345 -140 -1120 4143 -2950 -984 459 -2573 900000 209 900000 -521 900000 -4400 356 987 -1486 1665 900000 2643 -2776 900000 -4670 -548 -1039 -834 4098 1351 900000 3432 900000 -1888 900000 1508 5083 7898 1923 3653 -77 900000 -267 2035 1973 2103 2094 1578 3835 567 3635 2250 4188 656 3930 2476 2713 3497 -954 3616 2017 3089 1105 5411 2667 4117 6076 2747 6624 1670 4727 -591 1324 399 -291 -2212 1350 3390 817 5359 -5132 1460 -288 2145 3043 1962 3170 -8103 2259 -3626 -304 -1527 -3200 -2278 -3310 -292 -2014 1468 -3841 2574 -4499 -3295 -877 -3769 2110 -2129 1965 -2682 -3310 -2215 -1591 -1528 -5618 155 -143 3457 1896 8429 946 2278 1465 2509 3089 -1450 2954 1571 443 684 1449 -1426 -545 658 -1076 3878 1514 3544 -5079 -397 -2684 -3890 SS 20230727T042811.7Z 8608.186246 57 1 48.55 2 81.43 69.42 143.40 325.81 0.00 1 0.00 1 0 17 6.953e-01 1.985e-02 3.245e-01 7.687e-03 8.924794e-01 4.524736e-03 1.104787e-02 -6.000000e+00 4.071867e-01 233.44 -2.00 3.85 -2.00 322.24 0.00e+00 1.226319e-02 2.763940e-03 4.180265e-03 -6.000000e+00 1.950806e-02 282.76 -2.00 20.00 -2.00 321.77 0.00e+00 6.318 0.006 302.00 328.00 3 8.6289e-01 1.8416e-02 8.4139e-02 -6.0000e+00 1.0279e+00 6.6027e-01 2.6518e-02 5.6545e-02 -6.0000e+00 1.1139e+00 -8.9660e-01 2.6016e-02 3.1431e-02 -6.0000e+00 6.5834e-01 3.6916e-01 1.1669e-02 1.3902e-02 -6.0000e+00 2.7722e-01 1.6441e-04 -9.8105e-04 2.1213e-04 2.4583e-04 -6.0000e+00 1.9644e-02 -1.4374e-02 0.0000e+00 12 9 9 12 4 4 8.76 5.57 0.30 -0.01437 -0.02175 149 32 4 8 0 325.750 15.01 5.57 19.78 21.17 21.48 28.1 968.17 -253955 900000 -214449 900000 -174986 -147335 -192571 -187813 900000 -229219 900000 -199330 164389 -118190 26555 32169 -60649 262599 -103102 200757 -119528 900000 -79901 -16953 -31197 -20494 -27731 -60948 900000 -44811 170642 -15660 56047 11478 16491 69507 -48279 101190 -39243 156935 1704 43267 8773 57665 18161 21386 56850 31822 56572 6742 55267 29196 41966 31602 36934 32574 9253 32971 -4312 35474 1372 20391 14302 23104 21074 10110 29195 -366 22153 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