File name: Pandora141s1_Calakmul_20241201_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20241202T055534.0Z 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 v1.8.60 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20241201_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: 20241201 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 20241201T132023.0Z 9101.555821 73 1 46.71 2 76.72 118.96 82.31 122.42 0.00 1 0.00 1 0 25 1.191e-01 7.228e-03 1.200e-01 4.991e-03 4.429624e-01 2.723802e-03 4.779826e-03 -6.000000e+00 7.233766e-02 225.43 -2.00 3.11 -2.00 319.90 0.00e+00 5.017728e-04 8.908463e-04 1.136883e-03 -6.000000e+00 3.298108e-03 291.58 -2.00 20.00 -2.00 319.13 0.00e+00 4.245 0.000 302.00 328.00 3 4.5503e+00 7.9834e-03 4.5809e-02 -6.0000e+00 1.7806e-01 1.5533e-02 9.7015e-03 2.1826e-02 -6.0000e+00 1.9173e-01 1.4464e-03 7.7837e-03 1.0456e-02 -6.0000e+00 1.1512e-01 -3.6727e-03 4.0428e-03 3.0013e-03 -6.0000e+00 5.0248e-02 5.7236e-05 -8.5040e-04 1.6172e-04 3.9358e-05 -6.0000e+00 3.6732e-03 -6.3704e-02 1.0561e-04 12 9 1 12 9 1 99.94 19.94 0.26 -0.06370 -0.07009 17 23 1 5 0 2594.610 26.11 20.00 19.94 29.18 33.0 988.07 71842 -16425 -43309 8257 -23858 -2907 -47211 47208 -34083 9880 -35335 -41678 -4327 -7686 10347 -13413 16004 -15344 15403 -21378 -6295 -1386 1041 -418 1686 3381 -9183 -1656 -18664 -12253 -1928 787 1815 -6830 -2137 -6024 -4543 -1720 -2772 -122 1177 3482 -3400 4787 -2127 284 -815 -959 992 1450 297 2447 3076 1184 3574 -203 786 1648 -601 2508 268 1649 2432 2529 1324 416 1748 -226 704 1333 674 453 299 -241 174 70 -781 -1816 -1137 -1124 -1359 -1180 -2047 -2260 -1039 -668 -998 194 307 573 451 -207 431 241 -347 1578 1231 560 234 -161 -1009 -1547 -328 -83 -1645 -819 -639 -279 280 503 608 494 470 -15 312 -66 385 647 376 -394 482 -1 1 -758 739 420 618 -3 311 -279 -212 -371 -327 271 -738 19 43 131 140 -107 153 -158 417 -252 -913 106 -391 -38 -988 458 -800 166 -954 -1289 -109 -239 323 -601 600 -833 667 -1378 -365 -78 59 -26 110 230 -713 -117 -1520 -956 -149 67 170 -735 -219 -639 -511 -220 -427 -22 229 714 -779 1041 -500 66 -192 -228 237 358 79 698 943 394 1225 -75 294 616 -227 918 103 669 1076 1204 659 204 821 -109 358 749 414 292 195 -153 103 38 -402 -925 -609 -675 -921 -885 -1669 -1954 -941 -638 -1001 199 315 572 429 -187 367 205 -315 1551 1345 674 300 -208 -1263 -1822 -366 -93 -1952 -1016 -827 -377 399 766 977 817 775 -25 476 -97 563 972 591 -647 798 -2 2 -1197 1117 616 884 -5 479 -463 -372 -677 -616 528 -1511 41 92 287 307 -232 323 -323 SS 20241201T133042.2Z 9101.562988 76 1 12.15 2 74.60 120.09 80.33 123.45 0.00 1 0.00 1 0 17 4.616e-02 6.005e-03 2.769e-02 3.007e-03 3.926789e-01 1.612715e-03 4.227141e-03 -6.000000e+00 2.804289e-02 225.43 -2.00 3.11 -2.00 318.88 0.00e+00 7.024575e-04 3.836856e-04 3.895611e-04 -6.000000e+00 1.278776e-03 291.58 -2.00 20.00 -2.00 318.05 0.00e+00 3.695 0.000 302.00 328.00 3 3.3009e+00 4.4254e-03 3.9800e-02 -6.0000e+00 6.9026e-02 -1.2405e-03 5.1226e-03 1.8312e-02 -6.0000e+00 7.4333e-02 1.1931e-02 3.6301e-03 9.0085e-03 -6.0000e+00 4.4631e-02 -9.5125e-03 1.9249e-03 2.5688e-03 -6.0000e+00 1.9476e-02 3.5473e-04 -8.8237e-04 9.5844e-05 3.2949e-05 -6.0000e+00 1.4243e-03 -6.3252e-02 6.1331e-05 12 1 1 12 9 1 99.86 19.94 0.17 -0.06325 -0.06988 21 109 1 5 0 551.770 26.11 19.97 19.94 29.84 32.9 988.21 -4604 -23735 -10469 -11721 -11057 -30482 -17317 -10459 -2102 -7750 -5814 1510 -15153 6485 -4299 4638 -2205 3440 -808 -4986 1570 -2112 3575 -3679 1259 -228 -1491 -324 -617 -1712 -1909 179 -270 919 -2762 -2003 -2496 -656 -733 -2686 -190 -1807 624 162 385 336 -1229 -553 456 -27 -431 1034 1788 1075 1427 625 760 106 507 665 767 876 2201 2195 1566 707 -640 178 -112 1286 448 472 500 576 85 -340 -817 -1060 -1234 -1052 -1322 -1423 -1713 -1737 -753 -966 -159 420 193 681 334 151 242 241 570 83 659 460 52 -155 -401 -1378 -108 -182 -1020 -845 -974 -288 -135 536 753 130 419 -203 298 239 284 504 368 144 -275 -357 -151 80 501 383 333 472 500 648 78 -268 -328 57 -261 -222 151 -51 199 -370 -178 -199 -126 -877 -362 -403 -355 -1134 -599 -380 -79 -329 -253 65 -872 361 -309 348 -192 304 -79 -528 162 -229 378 -441 154 -30 -199 -42 -78 -219 -263 27 -45 158 -487 -350 -468 -139 -183 -787 -60 -617 217 58 138 121 -452 -202 167 -10 -173 439 806 514 708 322 399 56 265 347 410 495 1326 1402 1028 457 -403 111 -74 915 344 376 401 450 64 -238 -538 -686 -833 -777 -1077 -1258 -1613 -1710 -771 -1037 -176 475 219 757 357 154 235 233 572 90 772 579 69 -205 -517 -1697 -128 -216 -1267 -1094 -1307 -400 -194 811 1184 209 669 -316 444 345 408 740 561 228 -441 -570 -237 123 746 556 473 676 747 1021 129 -456 -572 102 -484 -424 294 -101 393 -724 -341 -372 SS 20241201T133925.5Z 9101.569045 79 1 3.11 2 72.82 121.09 78.68 124.35 0.00 1 0.00 1 0 17 3.416e-02 7.164e-03 2.398e-02 4.002e-03 3.561177e-01 2.139038e-03 3.851225e-03 -6.000000e+00 2.074910e-02 225.43 -2.00 3.11 -2.00 318.20 0.00e+00 5.482568e-04 4.129404e-04 3.645549e-04 -6.000000e+00 9.461747e-04 291.58 -2.00 20.00 -2.00 317.35 0.00e+00 3.335 0.000 302.00 328.00 3 2.9425e+00 5.7221e-03 3.5930e-02 -6.0000e+00 5.1073e-02 -6.5885e-03 6.5001e-03 1.6518e-02 -6.0000e+00 5.5000e-02 1.1027e-02 4.2493e-03 8.0866e-03 -6.0000e+00 3.3023e-02 -7.6679e-03 2.2272e-03 2.2876e-03 -6.0000e+00 1.4410e-02 7.4513e-04 -9.4488e-04 1.2707e-04 2.9311e-05 -6.0000e+00 1.0539e-03 -6.3103e-02 6.5686e-05 12 9 1 12 1 1 98.83 19.93 0.21 -0.06310 -0.07020 7 155 1 5 0 387.600 26.11 20.01 19.93 30.36 32.9 988.31 -8622 -1407 -1357 575 -3493 5947 -22264 7711 -10991 11462 -16409 -5046 1307 -1597 8879 -2395 -334 -3718 5045 -3434 362 386 -3928 4871 -3502 2824 -3251 -696 724 2159 521 -1034 1057 -3844 1577 -5249 229 -2229 571 1350 -1001 -725 -1170 219 -1148 477 -525 -795 -1487 302 363 491 2544 40 2631 1025 212 -349 340 1273 688 2184 1835 2075 606 1056 -1660 60 708 578 1401 -647 1245 -846 339 -591 -923 -343 -1659 -424 -1900 -1137 -1700 -1541 -1067 -804 -399 -131 645 696 770 86 621 83 364 621 595 286 515 -233 -883 -887 -814 -662 -707 -840 -1065 -423 140 366 893 708 54 18 -53 661 235 674 431 -326 -185 107 74 330 259 -66 948 122 426 -140 156 -171 -406 -163 145 75 -22 51 -274 17 -309 -214 -426 -73 -74 30 -178 268 -1360 398 -751 680 -1301 -381 105 -153 893 -299 -44 -536 706 -541 57 61 -664 804 -661 526 -643 -131 131 386 100 -221 241 -949 367 -1289 57 -645 187 500 -412 -315 -526 99 -529 218 -241 -365 -690 141 177 254 1370 23 1532 620 131 -217 209 777 430 1421 1276 1512 453 769 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