File name: Pandora32s1_GreenbeltMD_20231206_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20231207T055508.9Z 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_20231206_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: 20231206 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 20231206T154911.5Z 8740.659161 373 1 48.14 2 63.60 162.15 62.95 247.96 0.00 1 0.00 1 0 17 4.631e-02 7.063e-03 2.395e-02 3.361e-03 3.728636e-01 1.669859e-03 4.409039e-03 -6.000000e+00 2.602668e-02 223.27 -2.00 3.47 -2.00 318.60 0.00e+00 8.979761e-04 3.511417e-04 2.268702e-04 -6.000000e+00 1.148515e-03 279.27 -2.00 20.00 -2.00 317.96 0.00e+00 2.236 0.000 302.00 328.00 3 5.3558e+00 4.5039e-03 2.8964e-02 -6.0000e+00 6.4103e-02 3.6931e-02 5.1650e-03 1.8644e-02 -6.0000e+00 6.9754e-02 1.5947e-03 3.6041e-03 9.4287e-03 -6.0000e+00 4.1622e-02 -4.8310e-03 1.9097e-03 2.9040e-03 -6.0000e+00 1.7889e-02 1.6440e-04 4.3252e-04 9.5511e-05 3.0510e-05 -6.0000e+00 1.2314e-03 3.9231e-03 9.4023e-05 11 8 0 10 0 0 99.99 20.92 0.22 0.00392 0.00717 35 8 1 5 0 1375.410 25.58 20.01 20.92 10.68 3.7 916.02 -7132 -5520 -16150 -8021 3890 -27270 29027 -6839 -9013 -2923 -15266 -5173 278 1600 -4272 1620 -7528 -4774 4554 5960 2795 -3899 5341 -2383 2435 5245 268 2651 -2291 -4876 1970 -2013 7762 -168 -2454 -3423 -7276 -560 -2910 1397 -1332 370 -1494 414 545 540 3675 -312 841 -518 -858 419 1410 1764 -632 1211 -44 -701 1382 -116 1562 -129 1372 1726 439 359 -35 1084 -145 1433 780 -964 138 70 -376 -726 -1398 -754 -2414 -1078 -1344 -681 -1515 -2127 107 -959 463 664 371 506 -76 783 -389 617 222 707 894 743 721 -497 121 -1138 -663 -103 -819 -900 -808 -803 -129 151 917 209 621 -42 299 91 -218 358 67 -322 -526 -73 420 353 634 415 154 310 374 359 -195 -473 -353 53 626 -393 -103 -530 288 10 125 -16 -316 -291 -255 -874 -397 159 -1377 904 -328 -498 -165 -985 -311 18 119 -395 162 -889 -580 537 723 361 -536 680 -344 360 797 43 407 -349 -749 302 -356 1394 -35 -503 -676 -1558 -129 -816 443 -482 140 -597 166 219 218 1445 -126 336 -212 -369 192 687 905 -345 668 -25 -404 769 -64 866 -77 875 1186 315 249 -23 686 -97 1045 627 -822 117 58 -297 -529 -939 -481 -1604 -785 -1099 -607 -1456 -2142 111 -1058 529 780 439 587 -84 809 -380 579 218 751 1038 940 973 -684 159 -1410 -770 -119 -1005 -1162 -1080 -1111 -185 228 1457 342 1007 -65 442 129 -304 509 100 -504 -840 -114 646 529 918 581 209 416 527 542 -310 -776 -589 90 1112 -730 -196 -1018 554 18 231 -28 -551 SS 20231206T180633.7Z 8740.754557 454 1 2.06 2 63.55 197.60 88.79 270.26 0.00 1 0.00 1 0 17 2.683e-02 6.389e-03 1.401e-02 3.087e-03 3.794683e-01 1.534317e-03 4.517553e-03 -6.000000e+00 1.506897e-02 223.26 -2.00 3.47 -2.00 317.74 0.00e+00 8.743486e-04 2.535184e-04 1.183798e-04 -6.000000e+00 6.654081e-04 279.26 -2.00 20.00 -2.00 317.10 0.00e+00 2.232 0.000 302.00 328.00 3 2.4051e+00 4.0474e-03 2.9108e-02 -6.0000e+00 3.7114e-02 1.8806e-02 4.5817e-03 1.8881e-02 -6.0000e+00 4.0396e-02 -1.1739e-02 2.9262e-03 9.4685e-03 -6.0000e+00 2.4103e-02 1.4076e-03 1.5183e-03 2.8294e-03 -6.0000e+00 1.0354e-02 3.1696e-03 -2.0767e-04 8.5367e-05 3.0233e-05 -6.0000e+00 7.1361e-04 4.6820e-03 -5.7021e-05 12 1 1 12 1 1 93.83 20.90 0.27 0.00468 0.00312 6 39 1 5 0 293.240 25.58 20.00 20.90 10.43 3.7 915.32 651 -7757 247 -9526 -12051 -12148 -12898 -7156 -8479 -2520 -9711 -4794 -3486 -1597 1196 735 2285 -252 -950 3001 1200 1200 -269 1822 1348 -919 -47 -2951 1138 -2089 773 -792 1134 705 -2288 -853 -1791 -1525 -494 -694 286 -1045 249 -410 -107 266 -186 523 -695 -1040 642 975 1688 1581 1114 1063 840 -328 798 641 937 1281 2174 1004 465 279 313 -550 728 852 -286 183 -533 164 -237 8 -376 -786 -373 -478 -1082 -1321 -2220 -1596 -1110 -436 -666 -79 168 633 397 709 776 589 207 900 -69 566 117 -380 -221 -1028 -493 -377 -1080 -1274 -470 -238 -111 507 230 -51 25 170 48 597 773 159 184 155 -367 45 240 106 645 744 -150 957 566 329 436 -320 -20 250 -121 -91 -89 248 -111 -110 -266 -522 -576 39 -570 18 -743 -881 -830 -914 -536 -726 -220 -924 -447 -360 -190 162 113 375 -44 -178 564 236 236 -54 378 299 -217 -11 -701 249 -464 177 -202 314 207 -673 -238 -525 -500 -186 -300 134 -518 126 -212 -56 138 -97 269 -360 -547 347 559 1013 992 726 705 569 -224 535 425 627 894 1606 794 378 222 237 -412 559 707 -256 170 -498 149 -208 6 -291 -588 -285 -396 -977 -1283 -2284 -1689 -1213 -495 -783 -95 202 749 452 767 800 595 216 998 -82 719 157 -514 -289 -1283 -586 -448 -1343 -1649 -621 -322 -155 740 350 -80 39 256 69 828 1058 223 267 232 -561 67 356 155 915 1027 -202 1278 788 484 666 -502 -32 405 -202 -156 -156 439 -197 -194 -459 -879 -952 SS 20231206T183555.6Z 8740.774949 477 1 48.66 2 65.61 204.75 94.41 274.67 0.00 1 0.00 1 0 25 3.665e-02 5.103e-03 1.827e-02 1.782e-03 4.100115e-01 8.907524e-04 4.797205e-03 -6.000000e+00 2.059404e-02 223.26 -2.00 3.47 -2.00 319.19 0.00e+00 1.142669e-03 2.223604e-04 1.671273e-04 -6.000000e+00 9.088644e-04 279.26 -2.00 20.00 -2.00 318.56 0.00e+00 2.405 0.000 302.00 328.00 3 3.6880e+00 2.4569e-03 3.1470e-02 -6.0000e+00 5.0723e-02 6.3700e-03 2.8630e-03 2.0586e-02 -6.0000e+00 5.5197e-02 1.7896e-02 2.1773e-03 1.0445e-02 -6.0000e+00 3.2935e-02 -1.4712e-02 1.1556e-03 3.3586e-03 -6.0000e+00 1.4154e-02 7.1149e-04 2.4537e-04 5.0884e-05 3.4832e-05 -6.0000e+00 9.7449e-04 4.0417e-03 6.7266e-05 10 0 0 10 0 0 100.00 20.93 0.29 0.00404 0.00589 399 94 1 5 0 121.940 25.58 20.00 20.93 9.68 3.7 909.91 -17592 337 316 -13757 -3042 -24693 5057 -13505 -2203 -1933 -10519 -4883 -10794 4798 -5510 -398 2214 -2957 3047 383 2906 -1472 3104 -27 -1326 3126 -4158 -1523 -2982 -2215 1500 -3340 3254 -116 -1115 -2901 -2517 1260 -1870 1100 -1519 -1281 -2078 -1347 890 -318 1389 -720 -616 -240 199 1619 639 1557 286 547 914 -340 313 -83 1624 1470 1481 1763 -18 317 -137 347 482 791 634 -567 539 -171 -81 236 -107 138 -637 -190 -770 -1193 -1506 -1523 -553 -1064 40 -57 33 632 315 972 159 694 917 807 640 192 301 -339 -265 -817 -976 393 -644 -980 -648 -695 -268 60 284 141 279 274 146 430 41 297 -99 -244 -454 -21 246 57 478 313 65 879 337 520 -88 -168 -360 15 220 -231 -33 94 129 62 -39 -206 -437 -505 10 10 -468 -87 -804 131 -458 -76 -72 -435 -199 -524 240 -357 -28 168 -250 260 35 269 -142 291 -3 -147 353 -511 -179 -337 -247 174 -454 467 -18 -175 -443 -401 223 -405 274 -435 -390 -665 -438 286 -104 450 -237 -204 -81 70 616 264 676 131 258 441 -167 150 -39 769 741 817 1055 -11 194 -80 197 285 524 463 -438 417 -129 -57 154 -64 79 -379 -126 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