File name: Pandora101s1_Izana_20240412_L2Fit_fout2c22d20230904p1-8.txt File generation date: 20240911T151311.9Z 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_20240412_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: 20240412 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 20240412T071304.6Z 8868.300748 47 1 48.05 2 84.41 82.89 111.59 42.09 0.00 1 0.00 1 0 17 3.923e-01 2.362e-02 1.852e-01 5.946e-03 9.411956e-01 3.302296e-03 9.461706e-03 -6.000000e+00 2.223329e-01 227.69 -2.00 3.19 -2.00 321.84 0.00e+00 -8.559046e-03 1.628011e-03 5.876446e-03 -6.000000e+00 9.499898e-03 275.77 -2.00 20.00 -2.00 321.40 0.00e+00 9.090 0.008 302.00 328.00 3 2.9899e+00 1.1571e-02 9.1213e-02 -6.0000e+00 5.5410e-01 9.1354e-01 1.6055e-02 7.3206e-02 -6.0000e+00 6.0091e-01 -1.1776e+00 1.5726e-02 2.9478e-02 -6.0000e+00 3.5621e-01 4.7406e-01 7.4694e-03 1.0815e-02 -6.0000e+00 1.5384e-01 1.0165e-05 -9.1338e-04 1.4986e-04 9.7709e-05 -6.0000e+00 1.0162e-02 5.5023e-03 0.0000e+00 12 8 8 10 0 0 71.46 20.87 0.30 0.00550 -0.00136 63 16 1 5 0 762.570 20.87 15.00 14.40 19.13 0.0 958.30 -67537 -58810 -63133 -41782 -144241 -90812 -69883 -162813 -63814 -143395 -58744 -103468 61777 -77724 -8101 -57613 35183 -20470 -21181 -17835 -47848 -40661 -50625 37880 -139349 98118 -48390 14589 -46457 34065 -33061 16911 -20111 18162 -27306 9923 20528 14287 63941 31550 55109 43515 59103 32964 23083 12270 38422 6947 42342 25980 32964 34464 26845 32531 33254 45107 28107 32229 17690 20711 9202 23428 18316 21217 10218 13814 16083 12552 15289 10106 16430 11907 16581 8124 9859 -4098 -2480 -7815 977 -2012 828 340 -903 -1112 -593 2576 -403 1740 -2581 628 -2937 -434 -5231 -3184 -3566 -1758 -2691 -2105 -2664 -2332 -2644 -3436 -1063 -3791 -2756 -2122 -1465 -2129 -847 -782 590 -130 839 -224 378 437 -192 -66 278 704 1406 2900 1161 2103 984 1434 786 886 666 774 358 -305 -277 -195 454 -157 683 73 127 -731 -817 -1697 -854 -713 -765 -352 -2965 -1101 -773 -5235 -841 -4384 -886 -2563 394 -2212 -150 -1792 510 -546 -577 -465 -1463 -1249 -1708 659 -14028 1024 -1862 296 -1670 612 -1418 520 -1003 611 -1330 334 702 638 2150 1719 2588 2371 2741 1911 1432 839 2049 532 2430 1943 2618 3017 2786 3470 3740 4733 3215 3718 2185 2354 1206 2988 2587 3276 1815 2337 2747 2415 3312 2631 4295 3282 4125 1987 2078 -890 -522 -1895 260 -668 316 150 -438 -573 -323 1430 -239 1013 -1526 338 -1531 -213 -2754 -1839 -2453 -1293 -2347 -2097 -2846 -2414 -2488 -2847 -870 -3046 -2358 -1894 -1388 -2235 -1010 -1085 841 -198 1285 -338 544 669 -281 -102 448 1131 2129 4411 1737 3026 1390 1939 1071 1358 1120 1498 771 -659 -642 -487 1208 -433 1888 202 343 -1854 -1895 -3950 SS 20240412T072406.7Z 8868.308411 50 1 47.76 2 82.00 84.16 109.99 43.95 0.00 1 0.00 1 0 17 5.588e-01 9.373e-03 4.653e-02 1.297e-03 7.588060e-01 6.929698e-04 7.903399e-03 -6.000000e+00 3.167368e-01 227.69 -2.00 3.19 -2.00 321.07 0.00e+00 4.665004e-03 3.058783e-04 2.130202e-03 -6.000000e+00 1.353290e-02 275.77 -2.00 20.00 -2.00 320.62 0.00e+00 6.741 0.003 302.00 328.00 3 2.3487e+00 2.2115e-03 6.3095e-02 -6.0000e+00 7.8938e-01 1.6859e-01 3.1005e-03 3.8178e-02 -6.0000e+00 8.5604e-01 -2.0382e-01 3.3773e-03 2.3102e-02 -6.0000e+00 5.0744e-01 7.9193e-02 1.6322e-03 9.7035e-03 -6.0000e+00 2.1919e-01 1.3458e-04 -2.4404e-04 3.2857e-05 1.1105e-04 -6.0000e+00 1.4475e-02 4.7365e-03 0.0000e+00 12 8 8 10 0 0 39.18 20.87 0.29 0.00474 0.00290 401 102 1 5 0 119.100 20.87 15.00 14.41 19.61 0.0 963.73 -184955 -208399 -139323 -207800 -172051 -196240 -158108 -185478 -160675 -165708 -142733 -130871 -118856 -87260 -90496 -52977 -65387 -32377 -62359 -31931 -63858 -22236 -48864 -28962 -57944 -26711 -42150 -44168 -35944 -34015 -14617 -14962 -5859 -14761 -11177 -17355 -1941 -7958 4932 1882 5735 3873 5963 7188 3452 5334 549 5901 2756 7675 5803 8772 5689 7001 5362 6067 3325 2788 1354 1130 2580 3413 6188 4620 4396 2771 2888 1471 3892 1902 2728 1315 1501 176 -721 -1294 -2655 -2006 -2401 -692 -1311 -1314 -2220 -1532 -1270 155 118 709 715 647 -3 -602 -1194 -1345 -764 -709 464 313 58 -538 -674 -1101 -367 -1154 -1468 -1140 -726 -179 278 483 551 455 125 53 -112 219 63 97 216 115 408 768 554 373 180 -125 440 407 185 198 -5 -243 -106 -325 -99 -100 322 90 9 -88 -258 -340 -1661 -2716 -952 -2629 -1415 -2110 -1300 -2300 -1728 -1992 -1481 -1507 -1639 -1170 -1603 -771 -1224 -487 -1365 -541 -1495 -346 -1069 -572 -1642 -578 -1061 -1112 -869 -951 -425 -532 -219 -614 -426 -727 -80 -430 289 133 432 319 503 611 312 490 50 542 280 823 723 1192 879 1158 949 1112 636 524 249 208 500 750 1536 1307 1278 801 848 470 1403 734 1122 557 608 72 -268 -437 -889 -723 -1032 -323 -721 -819 -1506 -1093 -966 114 90 545 539 499 -2 -415 -825 -1019 -620 -677 510 364 71 -645 -733 -1142 -355 -1183 -1623 -1317 -825 -219 383 704 887 761 209 85 -169 323 96 156 366 197 670 1194 835 582 272 -181 629 601 317 360 -9 -513 -222 -732 -237 -235 760 214 20 -205 -560 -734 SS 20240412T073912.8Z 8868.318899 55 1 47.87 2 78.68 85.90 107.72 46.38 0.00 1 0.00 1 0 25 1.976e-01 5.874e-03 8.026e-03 3.696e-04 5.847346e-01 1.902719e-04 6.143461e-03 -6.000000e+00 1.120162e-01 227.69 -2.00 3.19 -2.00 319.95 0.00e+00 1.885265e-03 6.020778e-05 6.134677e-04 -6.000000e+00 4.785895e-03 275.77 -2.00 20.00 -2.00 319.45 0.00e+00 4.933 0.001 302.00 328.00 3 1.5740e+00 5.4460e-04 4.6494e-02 -6.0000e+00 2.7917e-01 5.1111e-02 6.6548e-04 2.7824e-02 -6.0000e+00 3.0274e-01 -4.8207e-02 6.2230e-04 1.4654e-02 -6.0000e+00 1.7946e-01 1.3388e-02 3.2472e-04 5.1187e-03 -6.0000e+00 7.7520e-02 1.3032e-03 -7.4711e-05 9.6782e-06 5.0342e-05 -6.0000e+00 5.1189e-03 4.3864e-03 0.0000e+00 10 0 0 10 0 0 32.29 20.87 0.24 0.00439 0.00382 1886 480 1 5 0 25.350 20.87 15.00 14.42 20.90 0.0 974.28 -70850 -61745 -66006 -72784 -76947 -73445 -67010 -58603 -57686 -56299 -54376 -43974 -34187 -25407 -17582 -14367 -11534 -9634 -8506 -7821 -8052 -8764 -7926 -7828 -8440 -7742 -9179 -10315 -10033 -6416 -3934 -970 -940 -3147 -5429 -5390 -3095 -513 272 808 811 841 1136 1543 1486 1042 1030 730 874 1790 2115 2145 2352 1857 1549 1411 620 227 83 602 1006 2166 2452 1973 913 511 -67 453 1022 821 699 329 373 -121 -513 -1275 -1794 -1702 -1213 -1182 -1041 -1674 -1702 -1351 -827 -172 250 579 675 710 413 -23 -234 -115 -273 68 571 511 -11 -273 -627 -631 -216 -643 -943 -864 -542 -242 407 400 509 332 306 55 154 257 206 140 -43 -214 -42 341 261 349 68 3 418 555 65 96 -215 -168 -131 -268 -109 -166 294 124 -11 -107 -134 -209 -914 -817 -940 -1028 -1051 -998 -966 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