File name: Pandora32s1_GreenbeltMD_20231122_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20231123T054440.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c12p1-8 Local principal investigator: Thomas Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 32 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20231122_L1_smca1c12d20221109p1-8.txt Full location name: Goddard Space Flight Center Short location name: GreenbeltMD Country of location: USA Location latitude [deg]: 38.9926 Location longitude [deg]: -76.8396 Location altitude [m]: 90 Local noon date: 20231122 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Based on session 11 with new SO2 and HCHO field cal First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.0059 305.1469 305.2878 305.4288 305.5697 305.7106 305.8515 305.9924 306.1333 306.2742 306.4150 306.5559 306.6967 306.8375 306.9783 307.1191 307.2599 307.4007 307.5415 307.6822 307.8230 307.9637 308.1044 308.2451 308.3858 308.5265 308.6672 308.8079 308.9485 309.0892 309.2298 309.3704 309.5110 309.6516 309.7922 309.9328 310.0733 310.2139 310.3544 310.4950 310.6355 310.7760 310.9165 311.0570 311.1974 311.3379 311.4784 311.6188 311.7592 311.8996 312.0400 312.1804 312.3208 312.4612 312.6015 312.7419 312.8822 313.0226 313.1629 313.3032 313.4435 313.5837 313.7240 313.8643 314.0045 314.1447 314.2849 314.4252 314.5654 314.7055 314.8457 314.9859 315.1260 315.2662 315.4063 315.5464 315.6865 315.8266 315.9667 316.1068 316.2468 316.3869 316.5269 316.6669 316.8070 316.9470 317.0869 317.2269 317.3669 317.5069 317.6468 317.7867 317.9266 318.0666 318.2065 318.3463 318.4862 318.6261 318.7659 318.9058 319.0456 319.1854 319.3252 319.4650 319.6048 319.7446 319.8843 320.0241 320.1638 320.3035 320.4432 320.5829 320.7226 320.8623 321.0020 321.1416 321.2813 321.4209 321.5605 321.7001 321.8397 321.9793 322.1189 322.2584 322.3980 322.5375 322.6770 322.8165 322.9560 323.0955 323.2350 323.3745 323.5139 323.6534 323.7928 323.9322 324.0716 324.2110 324.3504 324.4898 324.6291 324.7685 324.9078 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20231122T131543.3Z 8726.552584 131 1 48.12 2 78.01 128.67 144.45 7.88 0.00 1 0.00 1 0 25 2.885e-01 9.720e-03 1.666e-01 4.482e-03 5.866443e-01 2.308819e-03 6.723134e-03 -6.000000e+00 1.622757e-01 223.49 -2.00 3.47 -2.00 320.53 0.00e+00 2.493555e-03 8.997128e-04 9.553035e-04 -6.000000e+00 7.201261e-03 280.77 -2.00 20.00 -2.00 319.96 0.00e+00 4.668 0.002 302.00 328.00 3 3.3548e+00 7.0563e-03 5.4829e-02 -6.0000e+00 3.9967e-01 9.0252e-02 9.0001e-03 3.0293e-02 -6.0000e+00 4.3476e-01 -9.9564e-02 8.5538e-03 1.6163e-02 -6.0000e+00 2.5960e-01 3.6880e-02 4.3041e-03 5.5555e-03 -6.0000e+00 1.1167e-01 9.6541e-05 -5.8528e-04 1.2411e-04 6.3819e-05 -6.0000e+00 7.6737e-03 2.0857e-03 -3.6820e-05 12 9 8 11 8 0 99.95 21.14 0.37 0.00209 -0.00231 26 6 1 5 0 1850.680 25.79 20.00 21.14 13.49 3.7 931.06 74606 -114216 -76909 -53384 -118038 -116423 40901 -86087 -35585 -36983 -85293 -127876 6467 -61294 58127 -2076 -50623 -19440 -31647 58117 -37011 -32304 18251 -36919 23590 -16398 18153 -27489 -11275 -15442 -15320 -17727 23356 2577 -16530 -5456 4207 -6030 -7661 4398 5510 5920 3952 5768 3863 10654 4244 7077 7075 -498 718 -1854 6057 5173 2279 6525 1047 -352 -560 44 4073 697 2131 2151 1573 2029 3041 1225 509 3262 -336 -267 193 1232 -1141 -1911 -1523 -427 -2632 -727 -1980 536 -2392 -2849 -321 -788 278 170 484 685 761 -286 -126 -925 -328 1009 -472 1008 494 278 -318 -1932 -1269 -694 -670 -1137 -910 -419 -414 522 -433 345 107 784 520 13 10 -439 488 -72 -111 540 746 163 59 271 1010 780 -59 438 498 -570 -136 -317 425 -267 -316 -377 525 85 117 -444 -396 326 -1880 -981 -550 -2082 -1909 179 -1239 -363 -419 -1595 -3810 65 -1477 568 -43 -1876 -591 -1173 985 -1587 -1330 478 -1735 687 -738 610 -1390 -477 -697 -778 -1088 1137 167 -1273 -365 270 -492 -767 473 667 775 556 823 571 1500 648 1075 1112 -88 136 -400 1330 1239 596 1709 298 -102 -160 12 1106 209 706 796 627 801 1149 472 211 1491 -176 -147 107 653 -578 -889 -650 -177 -1183 -370 -1174 350 -1753 -2214 -258 -671 247 156 445 617 651 -232 -98 -716 -271 924 -492 1155 617 356 -394 -2241 -1352 -727 -738 -1328 -1104 -530 -557 756 -682 568 178 1271 809 20 14 -671 774 -119 -185 884 1184 253 89 398 1426 1110 -91 737 897 -1085 -265 -644 902 -591 -714 -863 1201 192 254 -929 -802 SS 20231122T143905.0Z 8726.610474 178 1 26.36 2 66.99 145.64 137.94 38.16 0.00 1 0.00 1 0 17 3.836e-02 6.912e-03 2.228e-02 4.045e-03 3.411674e-01 2.016309e-03 4.038243e-03 -6.000000e+00 2.160462e-02 223.49 -2.00 3.47 -2.00 318.23 0.00e+00 8.290736e-04 3.809683e-04 2.018028e-04 -6.000000e+00 9.597179e-04 280.77 -2.00 20.00 -2.00 317.55 0.00e+00 2.538 0.000 302.00 328.00 3 4.9705e+00 5.3857e-03 3.0288e-02 -6.0000e+00 5.3213e-02 4.3658e-02 6.1358e-03 1.7078e-02 -6.0000e+00 5.7895e-02 9.8049e-04 4.0905e-03 8.5686e-03 -6.0000e+00 3.4548e-02 -6.3057e-03 2.1507e-03 2.6092e-03 -6.0000e+00 1.4973e-02 1.9341e-04 5.3052e-04 1.1539e-04 2.7271e-05 -6.0000e+00 1.0287e-03 -1.2781e-03 1.3121e-04 12 9 1 12 1 1 99.99 21.18 0.43 -0.00128 0.00271 12 6 1 5 0 2027.180 25.79 20.00 21.18 14.07 3.6 934.10 900000 8081 -13527 1090 -17827 -14894 24844 -4919 4968 -7987 1987 -11200 -1676 198 772 5965 -5559 -2458 1942 4502 1376 -7046 4020 -797 139 -194 -343 -1332 -1347 3222 -3198 1011 6164 -922 -1400 -3372 -2906 -2636 -2268 779 -1071 436 -1895 -31 -495 964 2419 1202 1441 392 -1194 1117 351 2292 -807 1443 392 -873 503 195 2845 1091 1962 640 -10 664 -771 -323 11 658 226 -462 -30 -175 350 -1350 -493 -910 -1255 -535 -2212 -892 -1638 -1030 -55 -328 365 25 747 265 772 18 -60 733 332 454 562 317 951 -580 -514 -797 -803 -492 -703 -841 -780 -533 -104 394 113 430 1013 -94 838 -393 340 163 -76 -326 -411 300 368 489 252 343 -480 -16 607 661 -18 -641 -650 208 215 88 433 -508 213 -144 -72 126 -545 900000 427 -929 64 -1151 -866 1021 -296 309 -606 140 -905 -137 19 84 707 -793 -358 286 674 220 -1215 630 -137 25 -37 -68 -256 -245 549 -606 203 1306 -222 -331 -772 -689 -709 -720 282 -438 187 -855 -14 -226 437 1082 537 639 176 -568 560 188 1273 -478 859 240 -543 306 117 1692 693 1336 472 -8 488 -540 -219 7 503 190 -407 -27 -152 289 -1046 -349 -614 -866 -404 -1874 -816 -1607 -1045 -58 -364 422 30 893 312 868 20 -60 702 329 486 654 400 1268 -790 -676 -985 -938 -573 -864 -1086 -1040 -734 -148 587 177 690 1606 -145 1216 -548 465 228 -112 -499 -645 466 560 725 363 479 -649 -22 844 976 -28 -1026 -1056 345 370 158 788 -942 396 -266 -129 220 -933 SS 20231122T150219.8Z 8726.626618 193 1 48.34 2 64.62 151.03 134.98 44.99 0.00 1 0.00 1 0 17 2.197e-02 6.189e-03 1.656e-02 3.268e-03 3.136294e-01 1.620984e-03 3.729875e-03 -6.000000e+00 1.236667e-02 223.49 -2.00 3.47 -2.00 318.21 0.00e+00 7.579785e-04 3.015608e-04 2.358068e-04 -6.000000e+00 5.483879e-04 280.77 -2.00 20.00 -2.00 317.53 0.00e+00 2.318 0.000 302.00 328.00 3 5.1794e+00 4.3266e-03 2.7737e-02 -6.0000e+00 3.0459e-02 4.1278e-02 4.9281e-03 1.5711e-02 -6.0000e+00 3.3125e-02 8.2595e-03 3.2270e-03 7.8848e-03 -6.0000e+00 1.9781e-02 -9.0475e-03 1.6820e-03 2.3546e-03 -6.0000e+00 8.5139e-03 2.0010e-04 5.7180e-05 9.3935e-05 2.5201e-05 -6.0000e+00 5.8433e-04 -7.6677e-05 5.7803e-05 10 0 0 10 0 0 99.99 21.21 0.71 -0.00008 0.00035 64 15 1 5 0 755.270 25.79 20.01 21.21 15.33 3.7 942.33 -7139 -78 -4109 6207 -4373 -1421 124 -6255 -4154 -8453 -3638 -5983 9240 2797 -38 1804 -5709 1739 1110 3843 -50 -1478 4696 -2765 5155 -280 1032 -2425 -4368 -1195 -1029 3999 3856 247 -1930 -2088 -886 -3117 166 2004 -1327 -149 -3486 1110 -518 532 -236 -427 -1090 -1889 -702 978 1464 1585 30 901 56 1260 989 317 218 382 2189 1007 785 408 -148 -18 -517 1598 83 219 232 -233 170 -536 -194 -1159 -1661 -920 -1476 -1013 -1764 -868 -345 -507 174 10 483 241 993 12 167 199 -415 589 -10 795 486 -535 -113 -851 -554 -192 -708 -893 -537 -280 -253 1061 407 553 368 369 149 -438 191 -37 76 -27 -615 219 396 515 250 -159 -403 302 165 179 203 -530 -799 101 272 123 -53 -5 60 175 370 -304 -479 -442 -5 -298 403 -285 -84 7 -434 -319 -729 -304 -517 761 284 -5 241 -877 261 176 616 -9 -257 777 -513 948 -57 210 -494 -853 -221 -198 804 853 60 -466 -479 -210 -856 52 731 -554 -65 -1628 507 -241 246 -110 -195 -497 -869 -333 489 776 883 17 538 35 769 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