File name: Pandora101s1_Izana_20240812_L2Fit_fout2c22d20230904p1-8.txt File generation date: 20240813T011836.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c22p1-8 Local principal investigator: Alberto Redondas Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 101 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora101_OF_v3d20220624.txt Instrument calibration file used: Pandora101s1_CF_v22d20230904.txt Level 1 file used: Pandora101s1_Izana_20240812_L1_smca1c22d20230904p1-8.txt Full location name: Izana Atmospheric Research Center Short location name: Izana Country of location: Spain Location latitude [deg]: 28.3090 Location longitude [deg]: -16.4994 Location altitude [m]: 2360 Local noon date: 20240812 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Based on session 12 fieldcal with sens applied First and last pixel inside fitting window: 222 363 Nominal wavelengths inside fitting window [nm]: 305.1209 305.2618 305.4026 305.5434 305.6843 305.8251 305.9659 306.1066 306.2474 306.3882 306.5289 306.6697 306.8104 306.9511 307.0918 307.2325 307.3732 307.5139 307.6545 307.7952 307.9358 308.0764 308.2170 308.3576 308.4982 308.6388 308.7794 308.9199 309.0605 309.2010 309.3415 309.4820 309.6225 309.7630 309.9035 310.0440 310.1844 310.3249 310.4653 310.6057 310.7461 310.8865 311.0269 311.1673 311.3076 311.4480 311.5883 311.7287 311.8690 312.0093 312.1496 312.2898 312.4301 312.5704 312.7106 312.8509 312.9911 313.1313 313.2715 313.4117 313.5519 313.6920 313.8322 313.9723 314.1125 314.2526 314.3927 314.5328 314.6729 314.8129 314.9530 315.0931 315.2331 315.3731 315.5131 315.6531 315.7931 315.9331 316.0731 316.2130 316.3530 316.4929 316.6329 316.7728 316.9127 317.0526 317.1924 317.3323 317.4722 317.6120 317.7518 317.8916 318.0315 318.1712 318.3110 318.4508 318.5906 318.7303 318.8701 319.0098 319.1495 319.2892 319.4289 319.5686 319.7082 319.8479 319.9875 320.1272 320.2668 320.4064 320.5460 320.6856 320.8252 320.9647 321.1043 321.2438 321.3833 321.5229 321.6624 321.8019 321.9413 322.0808 322.2203 322.3597 322.4991 322.6386 322.7780 322.9174 323.0568 323.1961 323.3355 323.4749 323.6142 323.7535 323.8928 324.0321 324.1714 324.3107 324.4500 324.5893 324.7285 324.8677 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20240812T070403.0Z 8990.294479 47 1 47.92 2 84.54 76.13 168.95 42.08 0.00 1 0.00 1 0 17 5.991e-01 1.648e-02 1.744e-01 3.744e-03 9.367940e-01 2.097422e-03 9.505455e-03 -6.000000e+00 3.398798e-01 227.67 -2.00 3.19 -2.00 321.96 0.00e+00 3.222923e-03 1.190234e-03 2.526315e-03 -6.000000e+00 1.489803e-02 282.04 -2.00 20.00 -2.00 321.52 0.00e+00 9.244 0.008 302.00 328.00 3 1.9791e+00 8.1005e-03 8.4846e-02 -6.0000e+00 8.4524e-01 6.8370e-01 1.1982e-02 5.0028e-02 -6.0000e+00 9.1542e-01 -9.1493e-01 1.2227e-02 2.8222e-02 -6.0000e+00 5.4464e-01 3.6962e-01 5.5704e-03 9.6239e-03 -6.0000e+00 2.3672e-01 2.5677e-05 -1.1730e-03 9.2814e-05 1.3201e-04 -6.0000e+00 1.5518e-02 4.6705e-04 0.0000e+00 12 8 8 10 0 0 26.40 21.06 0.37 0.00047 -0.00835 193 49 1 5 0 248.270 21.06 15.00 14.63 28.37 1.3 796.93 -182221 -149739 -184760 -46710 -250414 -112008 -238146 -157171 -194956 -126432 -194041 -116142 -161947 -73430 -115989 -72670 64838 -62925 1349 -77022 -20262 -95121 -8143 -76782 -128087 -78306 -37244 -79070 -44308 -55956 -12802 -29453 -10259 2210 -30641 -2168 -26865 19535 7039 38148 5788 30426 18994 28459 5866 18829 13373 15573 27705 11324 28879 18249 30332 19883 27127 19873 29129 7752 15052 10338 12677 10776 17642 15549 12767 14278 10562 13806 6998 13511 7905 12508 5968 7856 1046 1442 -4445 -1927 -828 -612 1179 -48 746 -21 964 159 2968 42 2477 5 1446 -3520 -2961 -2750 -2414 -2486 -1575 -989 -1173 -1029 -2390 -1549 -2609 -1931 -4365 -1532 -1893 -1221 -1406 -233 -65 330 369 -141 -48 -642 337 22 310 515 1572 1127 1516 1061 931 530 1190 496 411 781 257 320 -431 -57 -339 141 444 361 -182 -123 -1170 -870 -2117 -1391 -2453 -171 -5070 -613 -4505 -1461 -2847 -1062 -3091 -1145 -3064 -831 -2541 -1220 308 -1172 14 -1743 -252 -2431 -92 -1878 -5518 -2087 -639 -1963 -793 -1328 -252 -839 -277 53 -951 -51 -902 499 249 1156 266 1155 832 1132 293 846 659 802 1365 732 1792 1419 2303 1822 2436 1995 2690 855 1456 1019 1282 1267 2273 2339 2065 2262 1793 2460 1403 2910 1934 2956 1430 1677 232 286 -925 -431 -201 -182 408 -19 326 -10 473 83 1568 23 1301 2 678 -1668 -1420 -1471 -1535 -1896 -1292 -933 -1192 -1022 -2185 -1336 -2091 -1593 -3641 -1307 -1734 -1222 -1623 -310 -98 486 551 -224 -73 -966 519 36 490 816 2537 1719 2224 1520 1297 715 1591 750 684 1495 550 737 -996 -143 -906 388 1231 1007 -498 -315 -2767 -2040 SS 20240812T071444.3Z 8990.301902 50 1 47.81 2 82.25 77.33 167.34 50.78 0.00 1 0.00 1 0 25 5.997e-01 9.705e-03 3.203e-02 9.296e-04 7.601248e-01 5.005624e-04 7.993898e-03 -6.000000e+00 3.402750e-01 227.67 -2.00 3.19 -2.00 321.15 0.00e+00 2.823854e-03 2.375465e-04 2.994604e-03 -6.000000e+00 1.491524e-02 282.04 -2.00 20.00 -2.00 320.63 0.00e+00 6.929 0.003 302.00 328.00 3 1.5212e+00 1.6776e-03 6.5247e-02 -6.0000e+00 8.4622e-01 1.4446e-01 2.3681e-03 4.0783e-02 -6.0000e+00 9.1648e-01 -2.0583e-01 2.4815e-03 2.2326e-02 -6.0000e+00 5.4526e-01 8.0612e-02 1.1819e-03 7.1355e-03 -6.0000e+00 2.3700e-01 2.7193e-04 -4.7596e-04 2.3835e-05 9.5727e-05 -6.0000e+00 1.5535e-02 2.4911e-04 0.0000e+00 12 8 8 10 0 0 -0.80 21.06 0.26 0.00025 -0.00333 903 230 1 5 0 52.940 21.06 15.00 14.63 29.00 1.3 801.55 -197658 -186776 -178078 -194175 -211899 -203894 -202303 -178583 -190218 -166569 -171267 -136016 -128712 -97354 -85071 -61740 -57495 -55684 -48664 -48741 -49499 -51382 -50173 -45078 -45806 -46336 -38236 -42917 -42678 -39407 -23289 -13427 -6937 -10173 -18828 -13891 -10185 -3341 -317 4394 2979 4953 4727 6787 5045 5610 4079 4404 3961 6503 6640 7286 7540 6584 7154 5608 5428 2945 2540 1665 3374 3971 6189 5301 4244 3256 1989 2073 2899 3116 2718 2105 1786 955 -544 -1949 -2740 -2113 -1399 -1080 -726 -1429 -1898 -1605 -878 -340 124 424 752 416 -161 -947 -1146 -1223 -1062 -505 112 249 -212 -503 -991 -1154 -925 -1295 -1585 -1297 -911 -440 285 540 720 593 554 48 197 171 146 101 154 -19 323 697 592 396 224 113 442 559 267 176 -65 -122 -199 -348 -270 -176 264 197 7 -154 -202 -284 -1809 -1761 -1614 -1936 -2343 -2144 -2365 -1910 -2569 -1902 -2220 -1529 -1797 -1315 -1295 -890 -902 -959 -842 -888 -915 -978 -1023 -972 -1079 -1151 -873 -1000 -1021 -1064 -673 -428 -240 -373 -713 -516 -420 -159 -18 283 216 378 378 541 417 476 366 417 404 716 758 931 1061 1018 1164 970 960 523 436 286 606 808 1430 1391 1159 879 552 617 988 1217 1150 837 747 372 -192 -630 -871 -718 -559 -476 -374 -843 -1216 -1087 -632 -258 98 338 587 308 -112 -628 -757 -882 -892 -458 118 297 -251 -580 -1124 -1157 -867 -1277 -1688 -1446 -1076 -521 378 813 1117 959 891 75 309 262 232 157 254 -33 519 1061 934 604 331 160 618 860 447 333 -126 -251 -435 -768 -638 -431 651 489 18 -355 -461 -606 SS 20240812T073118.4Z 8990.313408 55 1 48.09 2 78.69 79.18 164.49 60.66 0.00 1 0.00 1 0 25 1.952e-01 6.163e-03 5.947e-03 2.846e-04 5.729774e-01 1.467174e-04 6.068476e-03 -6.000000e+00 1.107432e-01 227.67 -2.00 3.19 -2.00 319.94 0.00e+00 1.394113e-03 4.771303e-05 7.116638e-04 -6.000000e+00 4.854101e-03 282.04 -2.00 20.00 -2.00 319.34 0.00e+00 4.931 0.001 302.00 328.00 3 1.0314e+00 4.2445e-04 4.6264e-02 -6.0000e+00 2.7540e-01 3.7121e-02 5.1996e-04 2.7346e-02 -6.0000e+00 2.9826e-01 -4.2518e-02 4.6939e-04 1.4063e-02 -6.0000e+00 1.7745e-01 1.0755e-02 2.4404e-04 4.4301e-03 -6.0000e+00 7.7137e-02 2.2718e-03 -2.8460e-04 7.5579e-06 4.5048e-05 -6.0000e+00 5.0553e-03 -2.6624e-04 0.0000e+00 10 0 0 10 0 0 -0.11 21.06 0.28 -0.00027 -0.00240 3334 849 1 5 0 14.340 21.06 15.00 14.63 30.28 1.2 810.60 -67469 -64488 -62821 -68568 -76989 -73405 -71261 -58458 -57761 -51833 -53872 -41146 -35953 -22938 -19593 -12223 -13338 -9013 -8854 -6700 -8413 -8924 -8230 -8473 -7027 -7223 -7117 -10530 -8874 -7770 -3361 -1173 -553 -4119 -5650 -6381 -3650 -915 410 1103 917 1261 1033 1847 1291 1542 914 979 623 1843 2088 2337 2295 1924 1703 1420 924 407 339 445 1186 1872 2685 1974 1056 407 -178 112 963 893 818 361 337 -66 -569 -1283 -1997 -1874 -1447 -1186 -1079 -1630 -1788 -1330 -838 -111 214 581 716 728 481 67 -166 -109 -192 39 512 501 113 -250 -737 -815 -382 -769 -1056 -936 -607 -216 429 536 603 445 399 164 167 215 56 112 -8 -244 -85 307 243 276 101 -41 398 591 238 135 -147 -177 -205 -304 -118 -145 265 135 -17 -115 -133 -181 -882 -920 -912 -980 -1107 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