File name: Pandora141s1_Calakmul_20250128_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250129T061429.9Z 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 v1.8.70 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20250128_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: 20250128 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 20250128T141715.3Z 9159.595316 99 1 60.65 2 68.03 119.20 64.15 132.19 0.00 1 0.00 1 0 17 1.476e-02 5.819e-03 1.443e-02 3.015e-03 2.885053e-01 1.598308e-03 3.149433e-03 -6.000000e+00 8.922756e-03 224.74 -2.00 3.11 -2.00 318.09 0.00e+00 9.540542e-04 2.955192e-04 3.256954e-04 -6.000000e+00 4.071016e-04 290.51 -2.00 20.00 -2.00 317.24 0.00e+00 2.649 0.000 302.00 328.00 3 5.6010e+00 4.2589e-03 2.8661e-02 -6.0000e+00 2.1935e-02 5.3256e-02 4.8333e-03 1.3324e-02 -6.0000e+00 2.3658e-02 1.5566e-02 3.0680e-03 6.5854e-03 -6.0000e+00 1.4200e-02 -1.3542e-02 1.5834e-03 1.9214e-03 -6.0000e+00 6.1807e-03 1.0537e-04 -6.6696e-04 9.7875e-05 2.4745e-05 -6.0000e+00 4.5567e-04 -4.8064e-02 -7.7699e-05 11 1 0 11 8 0 99.99 19.89 0.27 -0.04806 -0.05308 28 28 1 5 0 2165.480 26.00 20.00 19.89 30.57 36.4 987.02 -2265 3783 -6774 2021 -4047 1668 -6331 -2220 4195 1265 -120 -1547 1712 -2628 2395 1229 500 -407 919 -1273 -1971 -626 -1393 1861 2092 605 -1027 -233 3146 1229 2596 1511 1820 -259 -2838 -1172 -3390 182 -2288 -312 -1573 -1362 -63 -975 13 -733 -1684 -701 -478 -253 -519 496 416 1021 1260 359 219 -33 441 1033 982 853 2448 1661 422 789 94 -380 972 1088 784 784 212 538 95 -47 -1362 -1076 -1382 -711 -1008 -1870 -1750 -1234 -989 -773 539 147 220 416 140 318 74 -346 85 83 593 377 -104 -98 -504 -830 -168 -320 -596 -829 -676 -257 660 1228 782 412 216 325 -306 -17 -124 424 23 -138 -185 86 -230 40 240 113 -75 195 205 91 -439 -158 -243 162 93 -28 364 85 11 -125 -138 -312 -149 259 -527 139 -272 102 -440 -165 323 105 -10 -141 170 -313 310 177 77 -67 154 -227 -361 -114 -262 356 422 128 -219 -48 598 237 522 334 431 -64 -700 -284 -903 54 -817 -125 -693 -630 -30 -470 6 -354 -812 -331 -224 -120 -259 261 232 591 751 221 137 -21 272 635 622 575 1747 1249 321 573 65 -262 702 858 665 689 187 459 77 -36 -958 -734 -985 -553 -865 -1751 -1736 -1277 -1076 -884 637 178 266 490 156 332 73 -338 86 91 705 483 -140 -130 -645 -1004 -196 -381 -747 -1091 -923 -364 968 1881 1245 664 340 489 -439 -24 -170 599 34 -213 -291 134 -352 60 344 157 -101 266 291 136 -687 -253 -398 272 164 -52 673 159 21 -233 -251 -553 SS 20250128T143724.5Z 9159.609311 108 1 48.56 2 63.91 121.89 60.78 135.42 0.00 1 0.00 1 0 17 8.160e-03 5.481e-03 1.383e-03 5.227e-04 2.476958e-01 2.774881e-04 2.712465e-03 -6.000000e+00 4.934620e-03 224.74 -2.00 3.11 -2.00 316.89 0.00e+00 2.780795e-04 3.736998e-05 1.534417e-04 -6.000000e+00 2.250719e-04 290.51 -2.00 20.00 -2.00 316.07 0.00e+00 2.260 0.000 302.00 328.00 3 2.8351e+00 7.1971e-04 2.4452e-02 -6.0000e+00 1.2131e-02 4.5676e-03 8.0533e-04 1.1336e-02 -6.0000e+00 1.3082e-02 9.7922e-03 4.7649e-04 5.5680e-03 -6.0000e+00 7.8525e-03 -7.3783e-03 2.3271e-04 1.5830e-03 -6.0000e+00 3.4190e-03 2.6474e-03 -1.1862e-04 1.6704e-05 2.1492e-05 -6.0000e+00 2.5188e-04 -4.9125e-02 -1.6967e-05 12 1 1 12 9 1 99.98 19.88 0.15 -0.04913 -0.05002 367 455 1 5 0 131.940 26.00 20.00 19.88 30.99 36.8 987.27 316 -1229 -1370 -2914 -2280 -1419 -469 697 267 -1393 -1434 -639 -861 -270 123 -30 -88 296 629 453 415 276 760 1150 1069 498 -239 -327 363 950 1304 2076 783 -963 -2275 -1863 -1818 -519 -342 -933 -1155 -821 -620 -653 -416 -437 -706 -716 -547 95 338 853 862 726 553 801 611 308 418 548 1210 1444 1667 1028 360 -40 -196 462 1001 1040 344 298 274 178 66 -326 -509 -333 -525 -578 -1217 -1686 -1761 -1603 -953 -602 -317 37 60 203 241 139 223 522 482 462 486 242 -132 -404 -633 -602 -59 -48 -727 -726 -754 -249 256 615 480 268 143 30 194 511 612 562 229 -259 -250 -156 -49 122 238 240 638 671 462 239 -200 -288 -120 88 -91 -103 61 -56 -82 -186 -201 -292 42 -181 -205 -420 -299 -177 -61 99 42 -233 -243 -111 -166 -54 28 -7 -23 80 175 131 122 82 228 361 354 171 -82 -107 112 286 408 695 283 -361 -836 -677 -713 -216 -169 -494 -671 -501 -388 -413 -263 -275 -438 -434 -326 57 211 564 604 534 392 581 450 227 304 398 902 1147 1423 869 305 -35 -157 361 826 951 323 291 268 168 58 -280 -400 -268 -412 -503 -1118 -1708 -1798 -1729 -1089 -692 -383 45 74 241 284 150 236 538 521 515 599 309 -178 -540 -799 -749 -70 -59 -903 -957 -1044 -340 367 930 720 407 209 44 274 681 811 775 320 -384 -380 -235 -71 171 336 323 823 872 634 333 -293 -434 -186 134 -146 -173 101 -94 -139 -308 -338 -477 SS 20250128T145308.2Z 9159.620234 118 1 24.20 2 60.79 124.20 58.28 138.18 0.00 1 0.00 1 0 17 8.045e-03 5.670e-03 3.120e-04 1.473e-04 2.242996e-01 7.874660e-05 2.453067e-03 -6.000000e+00 4.864870e-03 224.74 -2.00 3.11 -2.00 316.32 0.00e+00 3.045023e-04 9.262532e-06 1.028398e-04 -6.000000e+00 2.218993e-04 290.51 -2.00 20.00 -2.00 315.53 0.00e+00 2.039 0.000 302.00 328.00 3 -6.3439e-02 2.0265e-04 2.2061e-02 -6.0000e+00 1.1959e-02 -8.3844e-03 2.2563e-04 1.0211e-02 -6.0000e+00 1.2897e-02 6.6428e-03 1.3121e-04 5.0202e-03 -6.0000e+00 7.7416e-03 -5.6490e-03 6.2214e-05 1.4331e-03 -6.0000e+00 3.3705e-03 6.1980e-02 -6.2079e-05 4.7029e-06 2.0125e-05 -6.0000e+00 2.4834e-04 -4.8923e-02 -2.2384e-05 10 0 0 10 0 0 9.05 19.88 0.18 -0.04892 -0.04939 2911 2911 1 5 0 8.230 26.00 19.99 19.88 33.50 36.5 987.52 -203 -761 -1471 -2455 -2582 -1722 -720 501 202 -1152 -1762 -1181 -486 105 174 -132 -87 449 583 557 594 719 915 1044 1112 700 22 -207 427 845 1287 1763 897 -888 -2000 -1883 -1551 -422 -370 -784 -1026 -844 -619 -565 -414 -392 -730 -684 -387 73 411 724 894 678 528 711 592 234 349 616 1161 1517 1633 1004 360 -150 -270 326 1057 994 392 271 316 132 25 -191 -531 -422 -565 -704 -1230 -1695 -1884 -1576 -1047 -636 -334 37 -11 189 229 195 187 609 493 529 515 256 -90 -375 -601 -650 -11 -20 -670 -740 -700 -258 232 625 447 255 94 32 255 516 557 569 240 -167 -186 -185 -86 163 258 244 588 698 438 267 -162 -282 -112 130 -90 -89 100 -85 -108 -242 -234 -389 -37 -150 -296 -470 -452 -285 -123 94 42 -253 -391 -268 -120 27 50 -41 -29 151 203 200 217 263 340 405 418 272 8 -83 160 309 485 709 357 -365 -869 -810 -663 -207 -200 -487 -652 -563 -423 -389 -285 -268 -490 -448 -247 47 274 510 665 529 398 546 462 183 269 474 918 1276 1472 898 321 -134 -225 264 903 886 381 275 322 129 23 -170 -432 -350 -457 -629 -1160 -1759 -1978 -1745 -1165 -753 -416 45 -14 232 262 215 202 638 510 598 608 314 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