File name: Pandora238s1_Granada_20250505_L2Fit_fout2c14d20240721p1-8.txt File generation date: 20250506T001925.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c14p1-8 Local principal investigator: Inmaculada Foyo Moreno Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 238 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora238_OF_v2d20220614.txt Instrument calibration file used: Pandora238s1_CF_v14d20240721.txt Level 1 file used: Pandora238s1_Granada_20250505_L1_smca1c14d20240721p1-8.txt Full location name: Andalusian Institute for Earth System Research (IISTA) - University of Granada Short location name: Granada Country of location: Spain Location latitude [deg]: 37.1640 Location longitude [deg]: -3.6050 Location altitude [m]: 680 Local noon date: 20250505 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are blind pixel subtraction, dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Based on 11 to update SO2 First and last pixel inside fitting window: 202 344 Nominal wavelengths inside fitting window [nm]: 305.1097 305.2506 305.3914 305.5322 305.6730 305.8138 305.9546 306.0954 306.2362 306.3769 306.5177 306.6584 306.7991 306.9398 307.0805 307.2212 307.3619 307.5025 307.6432 307.7838 307.9244 308.0651 308.2057 308.3463 308.4868 308.6274 308.7680 308.9085 309.0490 309.1896 309.3301 309.4706 309.6111 309.7516 309.8920 310.0325 310.1729 310.3134 310.4538 310.5942 310.7346 310.8750 311.0154 311.1557 311.2961 311.4364 311.5767 311.7171 311.8574 311.9977 312.1379 312.2782 312.4185 312.5587 312.6990 312.8392 312.9794 313.1196 313.2598 313.4000 313.5402 313.6803 313.8205 313.9606 314.1007 314.2408 314.3809 314.5210 314.6611 314.8012 314.9412 315.0813 315.2213 315.3613 315.5013 315.6413 315.7813 315.9213 316.0612 316.2012 316.3411 316.4811 316.6210 316.7609 316.9008 317.0407 317.1805 317.3204 317.4602 317.6001 317.7399 317.8797 318.0195 318.1593 318.2991 318.4388 318.5786 318.7183 318.8581 318.9978 319.1375 319.2772 319.4169 319.5566 319.6962 319.8359 319.9755 320.1151 320.2547 320.3944 320.5339 320.6735 320.8131 320.9527 321.0922 321.2317 321.3713 321.5108 321.6503 321.7898 321.9292 322.0687 322.2081 322.3476 322.4870 322.6264 322.7658 322.9052 323.0446 323.1840 323.3234 323.4627 323.6020 323.7414 323.8807 324.0200 324.1593 324.2985 324.4378 324.5771 324.7163 324.8555 324.9948 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20250505T083140.6Z 9256.355331 245 1 52.99 2 52.39 97.91 124.26 23.55 0.00 1 0.00 1 0 17 6.345e-02 1.737e-02 6.149e-02 1.288e-02 2.537099e-01 6.211392e-03 2.897695e-03 -6.000000e+00 3.421290e-02 230.04 -2.00 3.42 -2.00 318.04 0.00e+00 1.076129e-03 1.063896e-03 6.350120e-05 -6.000000e+00 1.502320e-03 281.24 -2.00 20.00 -2.00 317.30 0.00e+00 1.635 0.000 302.00 328.00 3 7.0811e+00 1.6734e-02 1.9897e-02 -6.0000e+00 8.5656e-02 1.0501e-02 1.8995e-02 1.2762e-02 -6.0000e+00 9.3313e-02 4.0325e-03 1.2080e-02 6.2362e-03 -6.0000e+00 5.5394e-02 -5.4773e-03 6.2455e-03 1.9388e-03 -6.0000e+00 2.3625e-02 7.0913e-05 -1.6151e-04 3.0995e-04 1.4049e-05 -6.0000e+00 1.3384e-03 1.3342e-03 0.0000e+00 12 9 8 11 8 0 99.99 20.77 1.28 0.00133 0.00012 15 2 1 5 0 3532.171 24.75 15.00 20.77 21.31 5.5 916.46 13354 -10619 4196 12381 1495 23314 21790 -5616 -7694 26413 -12348 12675 27299 8278 5977 1469 12755 -13091 11025 -6743 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541 -147 156 -1168 -257 -1139 342 -3630 160 -1745 -1030 -1854 -2169 454 1100 2951 -1949 350 2976 1587 -2201 1130 748 3382 -2140 -489 462 -1385 1252 -1475 1382 -1002 -400 -521 -600 -1627 -173 499 780 -385 435 2106 -542 -1333 -496 1045 3237 -1648 1701 2540 361 1384 2278 -2353 -39 285 -3740 413 706 2249 -668 -1088 -168 -1102 2044 254 -1290 -906 SS 20250505T085609.6Z 9256.372333 260 1 53.72 2 47.59 102.32 122.23 29.87 0.00 1 0.00 1 0 17 1.234e-02 6.392e-03 5.462e-03 1.877e-03 2.404126e-01 9.055037e-04 2.789701e-03 -6.000000e+00 6.651193e-03 230.04 -2.00 3.42 -2.00 317.04 0.00e+00 1.871259e-04 1.214419e-04 5.047283e-05 -6.000000e+00 2.920654e-04 281.25 -2.00 20.00 -2.00 316.33 0.00e+00 1.480 0.000 302.00 328.00 3 4.4313e+00 2.3923e-03 1.8402e-02 -6.0000e+00 1.6652e-02 2.6139e-02 2.6986e-03 1.2065e-02 -6.0000e+00 1.8141e-02 -2.0889e-03 1.6145e-03 5.9063e-03 -6.0000e+00 1.0769e-02 -8.3889e-03 7.9824e-04 1.6380e-03 -6.0000e+00 4.5927e-03 1.1830e-03 -5.6497e-05 4.3768e-05 1.3054e-05 -6.0000e+00 2.6023e-04 1.4756e-03 0.0000e+00 10 0 0 10 0 0 99.83 20.80 1.03 0.00148 0.00105 63 7 1 5 0 852.159 24.75 15.00 20.80 23.23 5.5 930.99 -22 -3191 -1167 -7219 -2266 -1696 -2445 598 2047 -3418 -3619 748 -517 11 592 -1648 -1083 1432 1010 968 541 2150 1465 583 -484 1703 -395 73 125 2089 1872 2169 2115 -1621 -1813 -1654 -1657 -1057 -507 -972 -1916 -583 -457 -1301 -741 492 -708 -379 -1295 1021 1143 681 909 585 -124 1325 776 868 740 625 1008 1108 1341 872 -859 -363 228 -466 603 1053 264 -333 -34 -48 543 439 369 -770 543 -535 -1101 -1646 -1687 -1143 -706 -983 -391 305 89 72 685 666 477 411 729 231 613 283 29 -424 122 48 -399 465 -1323 -842 -966 -978 -163 248 298 324 129 590 393 85 140 375 -278 -129 -433 206 346 -13 902 738 1151 694 79 -257 84 35 -359 639 130 -391 147 -355 -198 -538 21 -21 -180 -3 -434 -161 -908 -233 -180 -282 76 287 -523 -511 107 -88 2 129 -395 -257 351 255 254 144 589 436 168 -160 579 -134 22 35 583 577 685 763 -598 -567 -550 -619 -458 -268 -547 -1140 -352 -286 -806 -458 299 -420 -219 -805 622 695 437 610 421 -90 966 585 636 531 447 754 902 1177 827 -785 -288 175 -341 490 993 267 -352 -35 -47 482 342 291 -577 446 -462 -1053 -1779 -1874 -1207 -814 -1208 -501 397 116 88 751 735 472 403 787 253 740 389 41 -565 153 54 -465 542 -1738 -1120 -1362 -1333 -229 375 470 509 189 864 521 107 181 508 -382 -191 -634 295 486 -18 1207 957 1359 870 109 -370 119 49 -519 951 209 -667 247 -590 -324 -907 34 -33 -277 SS 20250505T090609.0Z 9256.379271 263 1 54.20 2 45.65 104.26 121.28 32.34 0.00 1 0.00 1 0 17 1.096e-02 6.139e-03 6.964e-03 2.308e-03 2.318033e-01 1.111043e-03 2.677040e-03 -6.000000e+00 5.907782e-03 230.04 -2.00 3.42 -2.00 317.19 0.00e+00 1.358867e-04 1.551683e-04 6.341125e-05 -6.000000e+00 2.594306e-04 281.25 -2.00 20.00 -2.00 316.49 0.00e+00 1.428 0.000 302.00 328.00 3 4.6448e+00 2.9335e-03 1.7742e-02 -6.0000e+00 1.4791e-02 2.2774e-02 3.3038e-03 1.1620e-02 -6.0000e+00 1.6113e-02 -5.1987e-03 1.9959e-03 5.6855e-03 -6.0000e+00 9.5654e-03 -6.1988e-03 9.9552e-04 1.5745e-03 -6.0000e+00 4.0792e-03 1.0203e-03 -8.0257e-05 5.4083e-05 1.2625e-05 -6.0000e+00 2.3121e-04 1.8248e-03 0.0000e+00 10 0 0 10 0 0 99.94 20.81 0.74 0.00182 0.00122 103 11 1 5 0 525.845 24.75 15.00 20.81 24.46 5.5 939.55 -1399 -4246 -214 -888 -3882 -4055 -668 1150 -247 -3061 -3083 723 -979 290 1339 -739 -2242 -1340 -554 1386 1541 1052 1233 548 -1123 993 -1453 -428 -447 1368 1309 881 1379 168 -3138 -1057 -1602 -22 -743 -820 -1180 -853 172 -1347 395 484 -263 282 -702 227 1594 -44 1048 1059 721 808 479 606 1103 664 1076 906 1315 920 -665 -521 -937 -815 690 749 642 339 109 -227 345 96 308 -494 -82 -765 -779 -1788 -1934 -1267 -725 -962 -511 35 108 227 806 600 234 138 577 119 633 331 -280 -131 157 90 -1088 828 -1238 -881 -699 -652 -207 546 459 281 36 627 351 127 387 82 208 -557 -254 255 291 56 958 499 798 659 170 -97 -135 -240 -47 501 95 -426 81 0 -33 -757 27 -42 -304 -167 -540 -27 -97 -373 -441 -76 146 -35 -466 -431 103 -166 54 285 -173 -528 -331 -139 354 398 259 326 154 -331 301 -442 -115 -121 372 391 271 481 58 -952 -335 -573 -9 -377 -441 -665 -492 102 -795 230 280 -162 169 -411 132 1004 -30 729 787 492 558 341 461 817 492 833 695 1086 818 -568 -426 -745 -615 575 661 601 332 104 -209 316 77 228 -344 -63 -678 -759 -1797 -1998 -1357 -846 -1197 -664 46 143 281 894 616 236 138 577 131 769 457 -399 -176 198 102 -1181 971 -1641 -1182 -992 -969 -290 825 723 441 53 921 466 160 501 112 310 -822 -371 365 445 80 1287 652 950 830 234 -139 -190 -338 -68 741 152 -721 136 1 -58 -1272 45 -66 -465 SS 20250505T091055.1Z 9256.382582 267 1 54.03 2 44.73 105.22 120.80 33.50 0.00 1 0.00 1 0 17 1.047e-02 6.191e-03 2.335e-03 9.444e-04 2.284966e-01 4.559304e-04 2.665328e-03 -6.000000e+00 5.644086e-03 230.04 -2.00 3.42 -2.00 316.57 0.00e+00 2.761766e-04 5.467310e-05 5.174318e-05 -6.000000e+00 2.478410e-04 281.25 -2.00 20.00 -2.00 315.86 0.00e+00 1.406 0.000 302.00 328.00 3 3.3037e+00 1.1966e-03 1.7484e-02 -6.0000e+00 1.4131e-02 2.6243e-02 1.3461e-03 1.1470e-02 -6.0000e+00 1.5394e-02 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