File name: Pandora141s1_Calakmul_20240821_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20240822T060736.0Z 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 v1.8.59 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20240821_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: 20240821 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 20240821T125133.5Z 8999.535804 260 1 33.72 2 74.36 82.50 81.98 263.01 0.00 1 0.00 1 0 25 5.313e-02 6.705e-03 6.371e-02 4.193e-03 4.304448e-01 2.278096e-03 4.574679e-03 -6.000000e+00 3.242286e-02 227.26 -2.00 3.11 -2.00 319.55 0.00e+00 9.121184e-04 6.672207e-04 6.323119e-04 -6.000000e+00 1.485684e-03 293.75 -2.00 20.00 -2.00 318.71 0.00e+00 3.643 0.000 302.00 328.00 3 4.6109e+00 6.5213e-03 4.0286e-02 -6.0000e+00 8.0076e-02 7.2758e-03 7.7869e-03 2.0290e-02 -6.0000e+00 8.6163e-02 2.9200e-03 5.9538e-03 1.0017e-02 -6.0000e+00 5.1725e-02 -8.8319e-03 3.1246e-03 2.8399e-03 -6.0000e+00 2.2476e-02 9.5311e-05 -6.8290e-04 1.3451e-04 3.6836e-05 -6.0000e+00 1.6414e-03 -4.9149e-02 -1.1318e-04 12 9 1 12 9 1 99.93 19.63 0.21 -0.04915 -0.05428 16 30 1 5 0 1983.170 25.79 20.00 19.63 32.32 22.9 984.77 -27573 -26452 -1503 -11523 -17080 -7110 9708 -7101 -11357 -19967 -18065 8423 3189 -3170 -4106 1478 34 368 -1719 -2023 16093 -2509 10211 86 -8141 -5546 6443 -4497 6756 2190 4450 -3071 -2864 -720 -2889 -1619 1171 -4670 -2763 529 -1136 -2930 -784 -2274 -530 7 643 6 498 -399 -243 357 2647 743 -408 -209 -126 363 254 924 317 4206 2863 1409 -297 840 -806 188 2026 1568 -368 969 -460 528 89 800 401 -1502 615 -1049 -972 -1593 -1646 -2158 -1424 -218 -106 384 -475 874 629 1070 -572 972 573 928 571 344 -173 -790 -1120 -585 409 -93 -1186 -700 -809 -522 531 298 304 -138 91 378 132 945 834 761 753 7 -484 -265 -402 -492 230 109 905 635 -177 273 -354 -423 -403 467 -427 -447 167 87 -25 -122 220 34 -559 -599 -28 -233 -342 -127 159 -153 -284 -580 -540 213 99 -125 -192 75 2 22 -111 -138 955 -181 676 7 -735 -511 534 -403 534 186 406 -339 -348 -89 -361 -201 154 -763 -527 113 -273 -764 -209 -627 -145 2 177 2 141 -118 -77 122 953 289 -167 -89 -54 156 108 392 140 1922 1444 768 -167 457 -431 100 1146 982 -252 682 -328 360 58 473 223 -842 360 -697 -720 -1300 -1436 -1991 -1378 -220 -111 412 -512 907 622 996 -516 871 546 967 655 429 -227 -1038 -1415 -693 464 -108 -1445 -890 -1072 -722 767 459 489 -227 148 593 198 1370 1212 1141 1177 12 -796 -430 -640 -764 345 159 1285 921 -274 447 -611 -755 -740 883 -845 -914 346 182 -53 -252 443 67 SS 20240821T130341.8Z 8999.544234 263 1 19.28 2 71.51 83.36 84.73 264.05 0.00 1 0.00 1 0 17 5.670e-02 7.525e-03 4.690e-02 5.282e-03 3.767141e-01 2.841312e-03 4.077176e-03 -6.000000e+00 3.457410e-02 227.26 -2.00 3.11 -2.00 318.87 0.00e+00 1.326753e-03 6.674031e-04 5.207075e-04 -6.000000e+00 1.584789e-03 293.75 -2.00 20.00 -2.00 317.99 0.00e+00 3.113 0.000 302.00 328.00 3 5.0959e+00 7.8149e-03 3.4649e-02 -6.0000e+00 8.5389e-02 2.9176e-02 9.0413e-03 1.7689e-02 -6.0000e+00 9.1906e-02 -8.7844e-03 6.2549e-03 8.7040e-03 -6.0000e+00 5.5171e-02 -2.7886e-03 3.3004e-03 2.4690e-03 -6.0000e+00 2.3954e-02 1.0132e-04 -1.6542e-03 1.6944e-04 3.2048e-05 -6.0000e+00 1.7526e-03 -4.7563e-02 -2.6084e-04 12 9 1 12 1 1 99.93 19.63 0.32 -0.04756 -0.05999 7 25 1 5 0 2408.420 25.79 20.00 19.63 32.99 22.9 984.93 -12180 21851 -22252 3110 13612 23081 -32638 -13207 -6373 -9355 84 -15033 -705 -7936 7123 -11780 8805 -4521 1700 -2636 -4975 7844 -3936 5540 -1650 -616 -635 4148 219 9348 8749 1097 -448 -2978 2276 -7591 -4807 1967 -4003 140 -2385 1436 734 -1288 -1603 -134 234 -3609 343 -1816 1945 -1232 419 1025 3528 1560 -576 64 -212 1328 958 1998 1341 1448 1161 662 1471 1104 1577 -577 352 427 339 458 -153 900 -950 451 -1772 566 -1050 -1401 -1536 -1852 -455 -1779 542 -221 163 -554 1381 74 187 980 -542 541 658 -12 -120 -296 -973 -1221 559 -616 -689 -1259 -360 -677 764 434 468 240 -199 262 151 249 198 517 812 -111 231 -358 351 -103 458 -297 340 -84 1031 240 -224 461 -539 -2 17 -208 -209 -99 118 7 310 -764 -427 621 -997 106 393 594 -1501 -566 -283 -453 4 -852 -40 -569 515 -1143 762 -472 176 -297 -588 832 -480 655 -222 -85 -88 533 28 1131 1151 172 -78 -547 391 -1433 -957 427 -1081 42 -797 491 262 -476 -599 -50 87 -1376 127 -708 777 -543 194 497 1736 803 -307 34 -112 690 515 1134 827 942 767 425 902 681 1031 -420 272 343 271 355 -113 609 -612 283 -1190 411 -855 -1243 -1448 -1835 -468 -1942 605 -253 186 -621 1453 75 179 929 -546 587 776 -15 -160 -394 -1248 -1483 649 -732 -857 -1643 -484 -950 1110 666 747 390 -320 404 223 357 284 758 1237 -176 370 -571 546 -157 674 -426 476 -120 1527 377 -368 778 -938 -3 32 -398 -409 -196 234 14 588 -1424 SS 20240821T130948.0Z 8999.548472 267 1 28.35 2 70.07 83.80 86.11 264.56 0.00 1 0.00 1 0 17 2.337e-02 6.722e-03 1.016e-02 1.676e-03 3.534566e-01 9.009405e-04 3.880465e-03 -6.000000e+00 1.426710e-02 227.26 -2.00 3.11 -2.00 318.31 0.00e+00 -2.750685e-05 1.781949e-04 8.011824e-04 -6.000000e+00 6.535740e-04 293.75 -2.00 20.00 -2.00 317.41 0.00e+00 2.902 0.000 302.00 328.00 3 3.7543e+00 2.4259e-03 3.2414e-02 -6.0000e+00 3.5236e-02 4.3232e-03 2.7624e-03 1.6985e-02 -6.0000e+00 3.7911e-02 -3.2695e-03 1.7958e-03 8.0180e-03 -6.0000e+00 2.2759e-02 -2.3480e-03 9.3973e-04 2.3683e-03 -6.0000e+00 9.8908e-03 4.9446e-04 -2.5649e-04 5.3571e-05 2.8821e-05 -6.0000e+00 7.2196e-04 -4.6996e-02 4.1595e-05 12 9 1 12 9 1 99.93 19.63 0.21 -0.04700 -0.04892 47 102 1 5 0 590.410 25.79 19.98 19.63 33.17 23.0 985.12 -2203 -10067 -1032 -12946 -1582 -12925 -5257 -6436 -1870 -3976 -4421 -4371 -3804 -2778 -3854 -299 -2117 323 272 -262 73 890 1439 190 1547 -142 391 -224 734 -1765 -2033 74 -329 -1803 -3861 -2633 -2163 -627 162 -1625 -1146 -735 21 -572 -748 -525 -719 -199 -679 418 501 1203 1689 1553 1639 1997 1778 252 170 510 1580 2195 2580 1520 1019 201 -339 120 786 1237 478 821 620 97 -173 -625 -1356 -2170 -1972 -1730 -1252 -1680 -1424 -1322 -710 -326 -188 357 128 -83 -234 -962 -1104 -613 -433 164 610 174 130 -587 -500 -753 -70 -228 -1012 -580 -294 388 715 1010 942 908 563 314 399 466 507 285 232 -337 -280 -40 -21 314 303 -187 147 626 186 129 -314 -705 -545 -360 -400 -127 15 288 187 -50 -57 -47 -101 -558 -54 -733 -74 -657 -262 -366 -113 -262 -301 -317 -312 -265 -431 -36 -280 44 39 -39 11 137 227 32 278 -27 74 -41 128 -316 -392 15 -75 -431 -921 -620 -551 -169 52 -616 -479 -300 9 -245 -322 -226 -308 -91 -313 196 230 593 888 866 951 1191 1083 156 104 310 981 1456 1723 1092 743 141 -228 80 560 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