File name: Pandora141s1_Calakmul_20241229_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20241230T060633.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 141 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20241229_L1_smca1c3d20231011p1-8.txt Full location name: Calakmul Atmospheric Observatory Short location name: Calakmul Country of location: Mexico Location latitude [deg]: 18.5956 Location longitude [deg]: -89.4137 Location altitude [m]: 275 Local noon date: 20241229 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: OoB session based on session 2 First and last pixel inside fitting window: 238 379 Nominal wavelengths inside fitting window [nm]: 305.1074 305.2483 305.3892 305.5302 305.6711 305.8120 305.9528 306.0937 306.2346 306.3754 306.5163 306.6571 306.7979 306.9387 307.0795 307.2203 307.3611 307.5018 307.6426 307.7833 307.9240 308.0647 308.2054 308.3461 308.4868 308.6275 308.7681 308.9088 309.0494 309.1900 309.3306 309.4712 309.6118 309.7524 309.8930 310.0335 310.1741 310.3146 310.4551 310.5956 310.7361 310.8766 311.0171 311.1575 311.2980 311.4384 311.5788 311.7192 311.8596 312.0000 312.1404 312.2808 312.4211 312.5615 312.7018 312.8421 312.9824 313.1227 313.2630 313.4033 313.5435 313.6838 313.8240 313.9643 314.1045 314.2447 314.3849 314.5251 314.6652 314.8054 314.9455 315.0857 315.2258 315.3659 315.5060 315.6461 315.7862 315.9262 316.0663 316.2063 316.3463 316.4864 316.6264 316.7664 316.9063 317.0463 317.1863 317.3262 317.4662 317.6061 317.7460 317.8859 318.0258 318.1657 318.3055 318.4454 318.5852 318.7250 318.8649 319.0047 319.1445 319.2842 319.4240 319.5638 319.7035 319.8433 319.9830 320.1227 320.2624 320.4021 320.5418 320.6814 320.8211 320.9607 321.1003 321.2400 321.3796 321.5192 321.6588 321.7983 321.9379 322.0774 322.2170 322.3565 322.4960 322.6355 322.7750 322.9145 323.0539 323.1934 323.3328 323.4723 323.6117 323.7511 323.8905 324.0299 324.1692 324.3086 324.4479 324.5873 324.7266 324.8659 --------------------------------------------------------------------------------------- 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 20241229T140702.3Z 9129.588221 117 1 30.35 2 70.54 124.00 61.68 139.23 0.00 1 0.00 1 0 17 1.896e-02 5.904e-03 1.814e-02 3.352e-03 3.162090e-01 1.783439e-03 3.427236e-03 -6.000000e+00 1.149049e-02 224.74 -2.00 3.11 -2.00 318.15 0.00e+00 8.361145e-04 3.384802e-04 3.336480e-04 -6.000000e+00 5.235299e-04 290.80 -2.00 20.00 -2.00 317.31 0.00e+00 2.967 0.000 302.00 328.00 3 5.0121e+00 4.7574e-03 3.1936e-02 -6.0000e+00 2.8247e-02 4.0858e-02 5.4039e-03 1.4599e-02 -6.0000e+00 3.0435e-02 1.2505e-02 3.4966e-03 7.2016e-03 -6.0000e+00 1.8274e-02 -1.2786e-02 1.8230e-03 2.0823e-03 -6.0000e+00 7.9819e-03 1.3637e-04 -7.3580e-04 1.0790e-04 2.6525e-05 -6.0000e+00 5.8488e-04 -6.5384e-02 5.0136e-05 12 1 1 12 1 1 99.86 19.94 0.24 -0.06538 -0.07091 12 26 1 5 0 2334.320 26.11 19.98 19.94 32.09 35.5 983.65 4978 2958 2923 3349 -4002 -2793 -6939 -9529 1913 -6683 -1553 -606 -5848 -54 3455 -3355 721 378 -3041 2163 -3279 842 -1071 4233 1901 -512 -396 -4090 -620 653 -773 3349 3166 721 -1576 -394 -2708 577 -1959 -73 -731 -264 -1452 -964 1018 -105 -1207 -1649 -77 -1196 -358 1442 429 1822 1072 1246 714 510 -277 -118 430 1774 1483 1469 262 -359 -170 -496 1362 485 12 1256 670 780 44 -606 -1228 -1331 -1911 -396 -1071 -1775 -1172 -1464 -735 -309 101 340 1155 334 479 -111 141 427 -173 57 260 605 -399 -283 -396 -786 -1108 -271 -402 -870 -425 -569 436 735 486 669 499 195 -140 121 135 79 186 127 -1 26 298 -14 -91 -180 47 424 242 350 -201 -280 -144 145 -359 4 -33 -79 244 256 -87 -517 255 172 178 198 -236 -156 -418 -653 131 -526 -120 -48 -547 -6 395 -456 101 56 -488 344 -564 141 -186 736 358 -102 -80 -824 -117 121 -152 694 712 172 -377 -92 -689 163 -663 -28 -307 -116 -671 -451 471 -49 -567 -771 -36 -564 -175 739 235 1033 633 753 440 316 -171 -73 270 1163 1044 1089 198 -265 -119 -345 978 381 10 1093 589 668 36 -466 -884 -929 -1384 -309 -919 -1657 -1155 -1511 -791 -347 118 406 1373 392 537 -118 142 421 -178 63 309 767 -532 -379 -512 -967 -1321 -324 -502 -1139 -574 -797 631 1111 763 1066 785 297 -204 169 187 112 275 195 -2 40 456 -22 -132 -254 65 584 347 527 -317 -452 -236 245 -629 7 -62 -147 458 475 -158 -921 SS 20241229T145423.5Z 9129.621105 140 1 19.77 2 61.62 130.82 55.26 148.43 0.00 1 0.00 1 0 17 1.239e-02 7.172e-03 1.048e-02 4.345e-03 2.262243e-01 2.317551e-03 2.493346e-03 -6.000000e+00 7.508924e-03 224.74 -2.00 3.11 -2.00 316.61 0.00e+00 9.975007e-04 2.921022e-04 1.609925e-04 -6.000000e+00 3.421252e-04 290.80 -2.00 20.00 -2.00 315.81 0.00e+00 2.093 0.000 302.00 328.00 3 5.9856e+00 5.9915e-03 2.2580e-02 -6.0000e+00 1.8459e-02 5.4415e-02 6.6825e-03 1.0376e-02 -6.0000e+00 1.9889e-02 5.7965e-03 3.9193e-03 5.1043e-03 -6.0000e+00 1.1942e-02 -4.7126e-03 1.8972e-03 1.5156e-03 -6.0000e+00 5.2160e-03 1.3411e-04 -8.8552e-04 1.3891e-04 2.0060e-05 -6.0000e+00 3.8222e-04 -6.5313e-02 4.7999e-05 12 9 1 12 1 1 99.32 19.92 0.13 -0.06531 -0.07197 4 15 1 5 0 3951.960 26.00 20.00 19.92 33.40 35.6 984.25 1809 -3608 -2260 1657 -5032 -2089 2344 -2676 2068 -2665 -4051 171 55 958 -2724 1597 -1956 1950 -1936 733 2863 -326 -368 1710 148 -785 972 1043 692 596 499 691 1142 463 -1497 -974 -3648 -758 -473 -92 -892 -240 916 -533 470 586 485 -1089 -305 271 -514 1319 -23 830 1148 579 108 -113 -355 -407 359 460 1281 1406 911 228 -324 -1427 75 1726 515 76 195 1065 -121 -108 -153 -1943 -1344 -1572 -1811 -1471 -1188 -1482 -747 187 224 457 795 680 253 -84 -1501 -581 -218 51 827 705 488 -12 -618 -1280 -488 -550 -917 -432 -395 -372 452 958 1536 498 557 166 -332 -56 569 -406 221 -404 1061 -227 -244 394 342 -253 -193 62 -55 397 -287 -734 -58 -95 -51 -64 296 -155 445 62 207 -880 266 -609 -387 263 -783 -299 330 -432 350 -494 -769 32 11 215 -707 433 -575 572 -606 231 904 -106 -121 572 52 -288 351 362 231 194 167 245 427 178 -572 -364 -1468 -335 -239 -52 -549 -154 596 -355 311 386 316 -705 -193 171 -336 891 -16 609 861 444 84 -88 -275 -315 282 378 1106 1259 822 199 -269 -1164 63 1530 490 75 194 1032 -113 -94 -125 -1546 -1083 -1359 -1697 -1472 -1246 -1619 -847 220 275 572 995 837 299 -94 -1597 -599 -229 57 978 887 639 -15 -790 -1565 -577 -658 -1147 -561 -529 -514 641 1405 2305 758 833 239 -456 -74 742 -544 307 -585 1556 -335 -355 559 471 -339 -251 81 -74 551 -413 -1078 -86 -144 -79 -104 487 -259 746 103 339 -1419 SS 20241229T145957.2Z 9129.624968 143 1 12.80 2 60.63 131.74 54.60 149.64 0.00 1 0.00 1 0 17 1.433e-02 7.792e-03 9.697e-03 4.437e-03 2.214948e-01 2.373348e-03 2.449295e-03 -6.000000e+00 8.688255e-03 224.74 -2.00 3.11 -2.00 316.33 0.00e+00 3.657181e-04 2.803344e-04 7.290807e-05 -6.000000e+00 3.958136e-04 290.80 -2.00 20.00 -2.00 315.54 0.00e+00 2.029 0.000 302.00 328.00 3 5.7095e+00 6.1118e-03 2.1951e-02 -6.0000e+00 2.1358e-02 4.5823e-02 6.8026e-03 1.0178e-02 -6.0000e+00 2.3011e-02 5.6989e-03 3.9668e-03 5.0101e-03 -6.0000e+00 1.3817e-02 -7.4841e-03 1.8950e-03 1.4364e-03 -6.0000e+00 6.0363e-03 1.9073e-04 -7.2155e-04 1.4147e-04 2.0312e-05 -6.0000e+00 4.4216e-04 -6.6517e-02 5.8750e-05 12 9 1 12 9 1 97.44 19.93 0.26 -0.06652 -0.07194 3 19 1 5 0 3197.350 26.11 20.00 19.93 33.62 35.6 984.30 -5247 2708 -726 -624 -6676 2585 -78 -3176 179 -1263 -775 -4924 -534 -1086 1380 -414 -1214 2315 -231 2549 1213 492 -1229 2819 2546 4601 532 -1180 1441 -93 1567 114 2075 -1430 -3624 -1596 -2022 -436 -676 -1608 131 -627 -127 -59 -968 -882 -2168 -747 428 669 678 268 1327 927 696 1124 587 -878 -838 1417 347 393 2607 1125 1128 -989 -150 575 809 119 1215 -518 357 400 -264 -533 -879 -331 -1465 -822 -878 -2071 -1339 -1938 -1325 -860 335 354 934 -203 1218 630 -614 115 108 838 481 490 620 313 -226 -1242 -539 -734 -476 -751 -599 -246 701 467 573 694 388 169 -109 135 -163 -292 982 29 -350 -231 -26 -61 456 -338 27 281 228 869 -243 -96 -305 44 67 -826 -211 489 635 -551 112 -384 -932 487 -138 -114 -1189 402 -13 -584 35 -262 -162 -1085 -122 -277 383 -126 -389 743 -78 863 424 174 -445 1022 965 1765 211 -457 522 -33 564 44 831 -601 -1515 -647 -862 -206 -364 -974 84 -423 -87 -41 -676 -613 -1504 -503 282 440 457 189 971 702 541 886 470 -710 -672 1117 281 332 2281 1030 1035 -886 -127 473 686 108 1168 -520 359 394 -251 -478 -739 -267 -1208 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