File name: Pandora32s1_GreenbeltMD_20230702_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20230706T145718.4Z 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_20230702_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: 20230702 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 20230702T123920.1Z 8583.527316 247 1 48.61 2 59.08 84.16 135.22 267.72 0.00 1 0.00 1 0 17 9.582e-03 6.020e-03 3.218e-03 1.173e-03 2.506468e-01 6.024819e-04 2.947735e-03 -6.000000e+00 5.581858e-03 232.74 -2.00 3.47 -2.00 316.97 0.00e+00 5.006123e-04 7.997699e-05 1.249468e-04 -6.000000e+00 2.475895e-04 288.98 -2.00 20.00 -2.00 316.13 0.00e+00 1.938 0.000 302.00 328.00 3 3.9887e+00 1.5969e-03 2.3283e-02 -6.0000e+00 1.4012e-02 1.0450e-02 1.7857e-03 1.3014e-02 -6.0000e+00 1.5114e-02 3.2092e-03 1.0503e-03 6.2794e-03 -6.0000e+00 9.0038e-03 -5.7215e-03 5.0709e-04 1.7328e-03 -6.0000e+00 3.8308e-03 1.0592e-03 2.5012e-04 3.3311e-05 1.8954e-05 -6.0000e+00 2.5542e-04 1.2519e-03 5.9463e-05 10 0 0 10 0 0 99.96 22.46 0.09 0.00125 0.00313 120 28 1 5 0 405.060 26.83 20.00 22.46 29.92 3.0 1026.41 1056 246 328 -1115 -4025 -1505 -1721 849 491 -1159 -302 -2911 226 -490 47 -113 -361 761 557 2298 1400 321 1270 357 1049 138 553 -1137 -587 -1087 327 785 1204 -60 -2742 -2385 -3016 -2063 -410 -247 -571 -728 -955 -525 14 338 -870 -293 -1074 -1081 312 643 1162 1113 632 458 1150 478 447 598 777 1067 1845 1625 949 -90 -447 -790 137 921 427 538 191 476 53 -285 -723 -1227 -1158 -1074 -1252 -1332 -1586 -1683 -748 -168 51 480 465 522 544 472 -407 -63 47 -72 416 676 457 195 -330 -1097 -960 -445 -717 -878 -665 -466 -112 617 468 607 519 411 -41 -223 -353 -169 24 70 -32 154 325 250 593 362 -167 292 46 233 149 -254 -218 54 238 -95 -44 354 215 109 -95 -500 -689 129 34 47 -159 -535 -180 -210 112 73 -186 -48 -475 39 -96 10 -27 -92 199 152 636 402 93 367 108 332 46 185 -373 -180 -324 99 252 415 -22 -990 -819 -1082 -824 -188 -130 -328 -439 -591 -329 9 211 -543 -178 -648 -646 190 413 780 778 457 337 856 359 332 439 578 828 1514 1409 842 -77 -360 -615 109 791 397 521 187 458 49 -248 -583 -943 -893 -894 -1138 -1305 -1643 -1804 -830 -195 61 594 581 643 642 526 -427 -63 48 -78 487 844 602 259 -426 -1347 -1125 -523 -887 -1140 -887 -639 -158 900 709 934 789 602 -58 -296 -462 -225 34 102 -47 231 478 360 825 490 -218 377 61 326 217 -377 -327 83 377 -156 -74 599 368 185 -159 -816 -1106 SS 20230702T130312.4Z 8583.543893 257 1 3.38 2 54.46 87.70 139.61 271.25 0.00 1 0.00 1 0 17 1.358e-02 8.801e-03 1.286e-02 6.560e-03 2.228666e-01 3.392441e-03 2.660852e-03 -6.000000e+00 7.905907e-03 232.74 -2.00 3.47 -2.00 316.03 0.00e+00 6.997876e-05 3.618428e-04 1.372892e-04 -6.000000e+00 3.508670e-04 288.99 -2.00 20.00 -2.00 315.24 0.00e+00 1.715 0.000 302.00 328.00 3 4.4595e+00 8.8745e-03 2.0643e-02 -6.0000e+00 1.9845e-02 1.4064e-02 9.8632e-03 1.1576e-02 -6.0000e+00 2.1411e-02 6.2141e-03 5.6725e-03 5.5899e-03 -6.0000e+00 1.2754e-02 -6.5472e-03 2.6158e-03 1.5356e-03 -6.0000e+00 5.4241e-03 8.6069e-04 -3.0642e-04 1.8430e-04 1.8525e-05 -6.0000e+00 3.6199e-04 1.3279e-03 -6.6842e-05 12 9 1 12 1 1 999.00 22.56 0.32 0.00133 -0.00097 1 7 1 5 0 1608.790 26.83 20.01 22.56 31.72 3.0 1036.63 3390 77 836 -868 -1672 1056 -2689 2676 -4781 -2290 -361 1269 490 -2467 289 91 -518 777 -1265 2648 2532 281 -17 3871 -610 -141 57 -1199 2951 -776 -531 1531 -807 908 -4710 -2789 -3877 -3620 1237 446 -1665 1066 -152 185 -313 -789 -545 542 -745 -530 -590 2444 1041 636 813 245 309 -1 64 1348 -512 1393 1271 1188 510 109 -623 409 1783 -190 344 129 346 16 772 452 -1637 -1780 -3181 -625 -201 -904 -1328 -2464 13 132 552 449 887 365 841 -237 -518 128 -45 -846 1193 64 825 222 -1504 50 -1586 -1026 -1039 -1194 -532 -175 750 405 501 97 753 1422 -205 -753 -393 1022 -40 293 -594 232 95 282 662 694 -196 344 -440 962 -136 -786 -163 -60 649 -393 194 -719 362 420 378 -626 -654 644 17 186 -190 -336 192 -513 534 -1130 -564 -88 301 124 -711 90 31 -185 280 -477 995 977 110 -7 1529 -261 -62 25 -520 1170 -305 -212 633 -361 416 -2181 -1219 -1767 -1822 686 280 -1140 745 -109 134 -228 -574 -393 380 -517 -364 -414 1760 788 499 653 199 256 -1 52 1091 -424 1184 1139 1112 485 101 -541 341 1503 -174 337 131 354 16 752 416 -1423 -1474 -2659 -548 -189 -912 -1407 -2701 15 155 669 558 1107 452 999 -269 -554 131 -47 -934 1385 80 1065 289 -1920 61 -1854 -1205 -1276 -1529 -697 -234 1024 573 732 144 1098 1989 -275 -972 -498 1312 -54 410 -854 333 134 391 891 907 -250 431 -569 1287 -189 -1112 -231 -87 964 -606 304 -1148 580 668 591 -965 -991 SS 20230702T130750.3Z 8583.547110 260 1 49.02 2 53.56 88.41 140.46 271.97 0.00 1 0.00 1 0 17 1.108e-02 6.638e-03 4.515e-03 1.993e-03 2.209311e-01 1.025894e-03 2.586307e-03 -6.000000e+00 6.455945e-03 232.74 -2.00 3.47 -2.00 316.48 0.00e+00 5.508672e-04 1.211844e-04 9.479156e-05 -6.000000e+00 2.862736e-04 288.99 -2.00 20.00 -2.00 315.67 0.00e+00 1.679 0.000 302.00 328.00 3 5.3025e+00 2.6999e-03 2.0255e-02 -6.0000e+00 1.6206e-02 2.7471e-02 3.0090e-03 1.1402e-02 -6.0000e+00 1.7480e-02 3.9812e-03 1.7435e-03 5.4981e-03 -6.0000e+00 1.0413e-02 -6.6930e-03 8.2015e-04 1.5286e-03 -6.0000e+00 4.4315e-03 3.8227e-04 4.0223e-04 5.6439e-05 1.6932e-05 -6.0000e+00 2.9533e-04 3.4537e-04 9.2431e-05 11 8 0 10 0 0 99.99 22.60 0.48 0.00035 0.00337 34 8 1 5 0 1441.630 26.94 20.00 22.60 31.97 2.9 1037.06 3438 83 471 -1522 -2961 -2356 170 1968 772 -398 -1322 -4355 -101 -2298 707 37 -1193 1087 949 2705 164 614 836 246 1120 -124 1379 -93 -143 -1664 737 116 2661 337 -2540 -2679 -3838 -1533 -1464 33 -522 -475 -719 -3 -444 78 -15 461 -1198 -1038 -163 646 673 779 750 686 726 448 230 420 803 1513 1496 1550 689 -81 -585 -1118 -159 1062 442 298 239 712 414 -471 -971 -1693 -1278 -1550 -1598 -1064 -1364 -1565 -249 -289 235 714 547 823 692 297 -425 -317 -119 -233 -214 848 705 327 -132 -1114 -1212 -219 -840 -970 -510 -334 -270 593 467 675 514 343 -212 -198 -634 -147 30 235 119 474 560 184 414 8 -273 74 102 130 72 -478 -279 37 165 459 -8 173 223 216 -27 -500 -795 539 15 88 -281 -500 -364 26 325 144 -80 -269 -899 -21 -558 187 11 -370 339 306 884 56 210 285 87 413 -48 534 -35 -51 -572 252 42 1019 137 -1025 -1030 -1543 -677 -750 19 -330 -314 -487 -2 -305 53 -10 303 -782 -669 -107 443 483 580 574 533 572 355 181 326 630 1233 1294 1411 640 -73 -490 -903 -130 937 422 298 241 705 395 -424 -807 -1335 -1005 -1313 -1477 -1055 -1428 -1695 -279 -339 287 895 692 1026 826 334 -449 -320 -122 -254 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