File name: Pandora141s1_Calakmul_20240813_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20260427T091102.7Z 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 v1.8.88 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20240813_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: 20240813 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 20240813T150045.0Z 8991.625521 142 1 5.77 2 43.65 88.46 144.18 106.84 0.00 1 0.00 1 0 17 1.035e-02 7.329e-03 6.939e-03 4.499e-03 1.782263e-01 2.434888e-03 1.975680e-03 -6.000000e+00 6.288187e-03 227.29 -2.00 3.11 -2.00 315.18 0.00e+00 3.683772e-04 2.258945e-04 1.029181e-04 -6.000000e+00 2.890786e-04 293.76 -2.00 20.00 -2.00 314.43 0.00e+00 1.380 0.000 302.00 328.00 3 5.5879e+00 6.2232e-03 1.5587e-02 -6.0000e+00 1.5529e-02 3.2985e-02 6.8906e-03 8.1728e-03 -6.0000e+00 1.6739e-02 4.2143e-04 3.9583e-03 4.0073e-03 -6.0000e+00 1.0048e-02 -6.4848e-03 1.7759e-03 1.1230e-03 -6.0000e+00 4.3381e-03 4.3557e-04 -2.0677e-04 1.4274e-04 1.7768e-05 -6.0000e+00 3.2032e-04 -8.9603e-03 2.1122e-05 12 9 1 12 1 1 999.00 21.03 0.30 -0.00896 -0.01051 2 31 1 5 0 1919.410 26.94 20.00 21.03 32.94 21.9 984.84 -1230 -538 -821 -2286 -3142 -3733 -52 287 820 -1174 24 -2034 1987 -2101 -8 -151 2042 1293 -255 1746 273 1479 563 -387 953 2287 -987 -491 2633 2027 2150 1615 -502 -1184 -1235 -616 -1164 -594 -948 -68 -1203 -905 -301 -69 -95 -1380 -100 -1657 -1403 56 631 1104 718 -36 52 1012 536 -462 224 209 738 1469 2264 1729 541 -592 -121 466 45 590 187 1443 578 47 13 515 -1608 -1151 -483 -555 -1786 -1811 -1200 -1277 -799 -500 -483 -126 237 422 51 -314 72 525 -488 1150 136 -264 428 -394 -752 -710 360 -112 -1361 -549 -423 -193 910 608 183 646 77 504 -223 -127 312 663 827 222 242 43 -79 -123 674 -208 354 483 -46 672 -93 -416 -320 115 622 -492 -101 -379 132 -274 -31 -579 -373 -169 -257 -681 -876 -1020 -14 87 263 -390 8 -695 708 -842 -4 -67 917 596 -121 833 133 715 277 -198 499 1199 -519 -247 1242 948 1032 812 -265 -624 -633 -316 -642 -364 -649 -50 -936 -721 -242 -56 -76 -1108 -78 -1281 -1069 43 490 885 596 -31 45 879 469 -406 194 183 660 1361 2173 1691 524 -549 -107 409 41 576 191 1491 598 48 13 467 -1398 -979 -422 -517 -1781 -1896 -1297 -1428 -926 -601 -596 -157 294 509 58 -344 75 542 -523 1286 162 -329 541 -492 -908 -828 413 -133 -1685 -698 -552 -258 1241 854 261 915 106 664 -283 -157 386 843 1091 303 335 59 -107 -163 863 -260 433 595 -58 878 -125 -564 -441 161 898 -731 -152 -578 201 -413 -47 -848 SS 20240813T150644.3Z 8991.629679 145 1 20.34 2 42.23 88.90 142.89 106.80 0.00 1 0.00 1 0 17 8.931e-03 6.751e-03 4.380e-03 2.766e-03 1.730052e-01 1.495611e-03 1.893281e-03 -6.000000e+00 5.425488e-03 227.29 -2.00 3.11 -2.00 315.28 0.00e+00 2.883715e-04 1.413278e-04 1.167887e-04 -6.000000e+00 2.494407e-04 293.76 -2.00 20.00 -2.00 314.51 0.00e+00 1.349 0.000 302.00 328.00 3 6.0633e+00 3.8274e-03 1.5169e-02 -6.0000e+00 1.3398e-02 4.6448e-02 4.2405e-03 7.8628e-03 -6.0000e+00 1.4443e-02 2.5955e-03 2.4349e-03 3.8502e-03 -6.0000e+00 8.6700e-03 -7.6363e-03 1.0956e-03 1.0800e-03 -6.0000e+00 3.7424e-03 2.8057e-04 6.3326e-05 8.8068e-05 1.6948e-05 -6.0000e+00 2.7640e-04 -7.1896e-03 5.6314e-05 12 9 1 12 9 1 99.97 21.03 0.42 -0.00719 -0.00671 6 21 1 5 0 2904.620 26.94 20.00 21.03 33.51 21.8 984.89 1878 -1019 -115 -1294 -1227 -1651 -731 2219 -966 460 -2482 -1828 6 1418 -547 -203 136 312 1687 -1329 375 785 737 1058 314 976 228 333 53 1920 1123 1745 -463 -1757 -1507 -2386 143 -561 -121 -995 -725 -1072 -298 -336 -462 -63 -1746 -458 -1111 505 651 843 780 -331 1716 542 799 -217 -251 608 567 1479 1199 1334 219 -474 -604 342 732 1076 1370 585 1094 -87 133 -975 -903 -1363 -574 -682 -1598 -1588 -1647 -1598 -394 -162 216 467 434 728 248 -471 -309 119 -548 21 568 84 -268 107 -631 -1183 -347 -570 -866 -731 -269 -166 765 634 853 307 251 29 337 271 116 210 78 617 23 478 120 185 86 -143 450 -137 451 148 -482 -492 86 -227 -146 -144 242 267 44 -1 -135 -701 535 -311 -34 -367 -322 -424 -196 635 -303 145 -801 -602 2 537 -227 -88 60 141 770 -633 178 372 354 525 162 506 117 162 25 870 527 852 -237 -904 -750 -1206 76 -339 -82 -734 -561 -854 -240 -270 -371 -50 -1373 -348 -837 378 501 673 643 -281 1462 472 696 -189 -219 529 507 1371 1160 1311 212 -438 -533 299 669 1046 1390 609 1130 -88 128 -887 -773 -1146 -497 -632 -1586 -1660 -1788 -1796 -458 -196 267 586 541 882 287 -517 -322 122 -586 23 676 105 -341 134 -763 -1380 -400 -677 -1073 -936 -353 -223 1052 897 1223 439 348 38 425 333 143 268 104 844 32 659 163 244 111 -179 548 -169 572 195 -647 -668 118 -321 -212 -215 366 408 68 -2 -201 -1031 SS 20240813T151135.0Z 8991.633044 148 1 12.03 2 41.08 89.27 141.84 106.78 0.00 1 0.00 1 0 17 7.569e-03 6.196e-03 4.647e-04 3.368e-04 1.659908e-01 1.833240e-04 1.823535e-03 -6.000000e+00 4.596922e-03 227.29 -2.00 3.11 -2.00 314.66 0.00e+00 2.999972e-04 1.534942e-05 4.670705e-05 -6.000000e+00 2.114085e-04 293.76 -2.00 20.00 -2.00 313.96 0.00e+00 1.325 0.000 302.00 328.00 3 1.7444e+00 4.6591e-04 1.4823e-02 -6.0000e+00 1.1352e-02 1.0665e-02 5.1446e-04 7.5909e-03 -6.0000e+00 1.2238e-02 1.4876e-03 2.9592e-04 3.7159e-03 -6.0000e+00 7.3463e-03 -4.6084e-03 1.3034e-04 1.0443e-03 -6.0000e+00 3.1704e-03 2.2164e-02 -7.4343e-05 1.0652e-05 1.6481e-05 -6.0000e+00 2.3427e-04 -6.8965e-03 5.3419e-06 12 1 1 12 9 1 96.13 21.03 0.16 -0.00690 -0.00746 290 1453 1 5 0 41.300 26.94 20.00 21.03 33.99 21.8 984.85 198 -136 -1272 -1744 -1508 -695 507 1056 424 -1320 -1061 -854 -99 210 211 -248 -31 590 552 722 493 900 935 1116 1109 432 -101 -51 649 803 1462 1825 473 -1450 -1995 -1747 -1503 -145 -483 -920 -1006 -768 -704 -583 -356 -626 -721 -715 -204 197 569 718 819 552 524 776 462 198 474 721 1271 1491 1539 679 132 -433 -343 398 1023 717 362 431 424 299 -14 -350 -783 -636 -768 -890 -1442 -1918 -1821 -1506 -878 -481 -121 139 106 351 164 108 141 619 302 548 514 210 -112 -410 -677 -593 122 -297 -790 -759 -619 -143 383 666 438 322 143 136 281 483 557 527 276 -145 36 -97 2 216 187 243 574 663 314 143 -315 -345 -51 47 -160 -50 177 -82 -49 -251 -262 -466 74 -53 -497 -631 -495 -236 168 385 167 -541 -430 -355 -42 98 101 -126 -16 314 301 378 261 503 500 621 642 255 -58 -29 347 420 785 1031 265 -818 -1152 -1015 -903 -95 -352 -718 -803 -634 -591 -489 -297 -514 -575 -578 -160 155 463 585 698 487 473 677 407 173 430 658 1146 1430 1497 682 128 -409 -315 360 943 700 364 446 435 307 -14 -332 -681 -560 -678 -829 -1425 -1973 -1982 -1658 -1026 -573 -145 169 128 419 188 117 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