File name: Pandora141s1_Calakmul_20250130_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250131T061911.9Z 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_20250130_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: 20250130 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 20250130T141638.8Z 9161.594894 95 1 2.43 2 67.95 118.57 80.95 110.64 0.00 1 0.00 1 0 25 9.529e-03 5.565e-03 3.536e-03 1.116e-03 3.035993e-01 5.961080e-04 3.313278e-03 -6.000000e+00 5.776379e-03 224.78 -2.00 3.11 -2.00 317.17 0.00e+00 5.114499e-04 8.629506e-05 1.784414e-04 -6.000000e+00 2.628011e-04 290.52 -2.00 20.00 -2.00 316.35 0.00e+00 2.641 0.000 302.00 328.00 3 1.0661e+00 1.5556e-03 2.8891e-02 -6.0000e+00 1.4203e-02 -6.0684e-03 1.7421e-03 1.3895e-02 -6.0000e+00 1.5302e-02 7.3264e-03 1.0473e-03 6.8457e-03 -6.0000e+00 9.1861e-03 -5.9753e-03 5.2355e-04 1.9556e-03 -6.0000e+00 4.0117e-03 9.9417e-03 -7.1679e-04 3.5408e-05 2.6348e-05 -6.0000e+00 2.9392e-04 -6.5951e-02 8.4742e-05 12 1 1 12 1 1 99.47 19.93 0.21 -0.06595 -0.07134 59 1487 1 5 0 40.320 26.11 19.99 19.93 31.20 36.7 985.44 -1561 -438 -1210 -1756 -4160 -2305 -2058 -139 360 -1602 -2278 -2456 -1716 -266 -51 -1078 329 621 -240 1118 -53 -286 935 1295 1472 589 40 92 -30 820 998 1707 1072 -750 -2311 -2680 -2052 -1287 -65 -687 -769 -953 -360 -306 -62 -172 -500 -513 -365 205 370 507 932 715 493 580 590 124 50 495 952 1462 1898 1475 686 74 -88 77 774 1022 630 200 347 304 126 -381 -427 -774 -777 -614 -1073 -1609 -1753 -1685 -1217 -814 -279 136 119 387 531 310 -65 451 283 319 481 357 107 -157 -654 -906 -358 -116 -510 -765 -757 -352 82 611 562 441 118 135 260 314 583 557 323 -47 -197 -150 -142 74 248 73 342 597 502 274 6 -191 -313 -26 -101 -13 133 65 -52 -250 -195 -393 -159 -49 -142 -201 -449 -232 -214 -16 45 -219 -321 -331 -256 -45 -10 -238 77 141 -57 274 -13 -73 242 351 423 178 12 27 -8 225 287 532 365 -250 -827 -948 -715 -515 -29 -354 -413 -546 -213 -184 -38 -103 -300 -303 -214 121 229 316 618 474 341 412 427 90 36 353 694 1133 1504 1250 565 62 -69 59 624 866 587 187 327 277 114 -330 -338 -620 -612 -536 -1006 -1600 -1798 -1834 -1342 -955 -331 166 145 457 615 346 -67 475 298 352 566 445 142 -210 -836 -1120 -419 -138 -643 -987 -1028 -481 113 898 841 675 177 198 369 421 800 761 469 -69 -300 -227 -210 105 348 102 459 801 685 401 9 -298 -484 -42 -165 -22 228 113 -91 -433 -326 -656 SS 20250130T142528.8Z 9161.601028 98 1 1.40 2 66.13 119.70 79.04 111.42 0.00 1 0.00 1 0 25 1.038e-02 6.200e-03 6.503e-03 2.424e-03 2.817671e-01 1.295922e-03 3.085443e-03 -6.000000e+00 6.291508e-03 224.78 -2.00 3.11 -2.00 316.82 0.00e+00 1.835762e-04 1.713420e-04 2.308400e-04 -6.000000e+00 2.862084e-04 290.52 -2.00 20.00 -2.00 316.00 0.00e+00 2.453 0.000 302.00 328.00 3 2.1972e+00 3.3604e-03 2.6811e-02 -6.0000e+00 1.5470e-02 2.0780e-04 3.7506e-03 1.2863e-02 -6.0000e+00 1.6665e-02 8.9713e-03 2.2235e-03 6.3284e-03 -6.0000e+00 1.0004e-02 -6.1951e-03 1.0897e-03 1.8127e-03 -6.0000e+00 4.3705e-03 3.9455e-03 -3.2238e-04 7.7153e-05 2.4835e-05 -6.0000e+00 3.2003e-04 -6.6905e-02 1.2573e-04 12 1 1 12 9 1 99.20 19.93 0.19 -0.06691 -0.06933 11 517 1 5 0 116.010 26.11 20.00 19.93 31.58 36.5 985.55 -1320 -1871 1558 -4657 -2637 -3241 -322 -1846 1186 219 -2039 -2677 -1273 -64 -677 -46 -157 1477 386 904 57 142 1549 1159 820 267 425 -827 -123 491 513 2802 172 -1028 -2026 -2409 -2185 -829 826 -233 -1267 -668 -756 -398 -190 -113 -217 -432 -1106 -162 251 896 699 491 653 855 666 150 265 369 956 1568 2155 1479 701 -211 66 -18 608 1028 559 387 106 219 -53 -438 -488 -507 -385 -1158 -1457 -1584 -1887 -1611 -1625 -632 -97 237 86 217 328 377 192 389 341 174 740 215 321 -349 -655 -1026 -287 -596 -520 -862 -958 -247 478 429 664 510 229 320 490 220 508 622 662 -15 159 -89 -340 280 158 -72 -21 508 651 372 -172 -204 -485 -26 -17 -218 -51 -84 59 -250 -111 -160 -166 -262 218 -669 -341 -400 -40 -259 179 36 -345 -472 -226 -13 -157 -12 -43 386 106 257 17 42 459 362 273 93 148 -280 -39 153 166 964 65 -383 -744 -937 -843 -365 399 -124 -758 -399 -467 -249 -119 -71 -134 -263 -668 -98 158 600 474 351 484 650 516 117 204 283 747 1232 1821 1272 615 -178 54 -14 514 913 521 379 105 210 -48 -378 -404 -400 -313 -1000 -1353 -1556 -2004 -1733 -1861 -735 -114 287 104 266 377 415 204 401 366 197 885 273 416 -456 -848 -1238 -340 -721 -642 -1135 -1278 -343 670 619 1005 760 345 455 669 295 671 848 922 -22 234 -131 -504 397 223 -97 -28 680 882 522 -256 -304 -744 -39 -27 -359 -87 -141 99 -428 -184 -264 SS 20250130T143529.8Z 9161.607984 104 1 60.08 2 64.08 121.06 76.89 112.35 0.00 1 0.00 1 0 25 1.866e-02 6.267e-03 1.934e-02 4.247e-03 2.691429e-01 2.263718e-03 2.945032e-03 -6.000000e+00 1.131465e-02 224.78 -2.00 3.11 -2.00 318.16 0.00e+00 2.464287e-04 4.177160e-04 1.907869e-04 -6.000000e+00 5.147370e-04 290.52 -2.00 20.00 -2.00 317.30 0.00e+00 2.274 0.000 302.00 328.00 3 5.8150e+00 6.0340e-03 2.5098e-02 -6.0000e+00 2.7820e-02 3.8591e-02 6.8442e-03 1.2428e-02 -6.0000e+00 2.9972e-02 2.8635e-02 4.3162e-03 6.1354e-03 -6.0000e+00 1.7993e-02 -1.9634e-02 2.2171e-03 1.7606e-03 -6.0000e+00 7.8590e-03 1.2441e-04 -8.4881e-04 1.3988e-04 2.3263e-05 -6.0000e+00 5.7562e-04 -6.6407e-02 1.0931e-04 11 1 0 11 8 0 99.99 19.93 0.44 -0.06641 -0.07279 245 245 1 5 0 245.190 26.00 20.00 19.93 31.94 37.1 985.58 -1298 5096 1490 3042 -3848 -1768 4975 -1624 8895 2376 -2892 -7240 -2441 -7167 588 157 4586 -1468 154 -228 384 725 -421 3219 -2911 1152 -1334 4273 2129 2286 3145 1240 732 -3108 -2468 -3027 -1563 -289 156 -293 -1486 -1344 -899 49 -2289 -31 -1270 -1859 -1186 -574 1581 1089 1424 128 675 324 1011 -316 -91 1287 -151 1230 1343 2712 1103 -134 -796 -1219 861 304 914 644 727 253 1276 -356 -622 96 -1724 -353 -1779 -1287 -1812 -900 -694 -507 165 174 446 379 935 33 67 199 -371 697 285 1028 280 -183 -873 -861 -989 -441 -555 -1258 -516 -206 190 193 509 635 -12 466 -336 176 -269 436 -83 -21 -107 0 -254 420 504 -425 506 67 439 77 445 -74 -109 294 -176 -160 102 44 139 83 -276 -523 -92 374 117 229 -286 -123 336 -128 707 212 -277 -742 -262 -912 79 23 696 -246 26 -41 70 133 -79 614 -621 246 -292 858 417 438 620 268 171 -777 -601 -730 -394 -82 52 -113 -639 -612 -421 23 -1106 -15 -601 -869 -546 -265 743 547 757 72 392 194 612 -194 -55 768 -94 797 936 1970 821 -96 -543 -815 591 230 748 553 629 214 1011 -264 -423 62 -1161 -257 -1459 -1151 -1743 -905 -737 -570 194 211 541 449 1042 34 65 187 -363 731 330 1283 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