File name: Pandora32s1_GreenbeltMD_20240523_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240524T050937.8Z 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 v1.8.59 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20240523_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: 20240523 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 20240523T122252.3Z 8909.515883 268 1 4.32 2 62.14 85.00 121.86 262.52 0.00 1 0.00 1 0 25 1.399e-02 6.460e-03 1.268e-02 4.182e-03 2.919385e-01 2.140671e-03 3.477301e-03 -6.000000e+00 8.105550e-03 231.63 -2.00 3.47 -2.00 317.09 0.00e+00 6.974674e-04 2.919426e-04 1.794885e-04 -6.000000e+00 3.558025e-04 285.26 -2.00 20.00 -2.00 316.32 0.00e+00 2.129 0.000 302.00 328.00 3 3.7607e+00 5.6688e-03 2.6079e-02 -6.0000e+00 2.0316e-02 7.1487e-03 6.3428e-03 1.5150e-02 -6.0000e+00 2.1958e-02 4.7615e-04 3.7748e-03 7.3612e-03 -6.0000e+00 1.3062e-02 -5.5761e-03 1.8472e-03 2.0494e-03 -6.0000e+00 5.5418e-03 1.0348e-03 -3.8592e-04 1.1780e-04 2.2579e-05 -6.0000e+00 3.7295e-04 9.4771e-03 1.7754e-05 12 9 1 12 1 1 67.96 22.43 0.23 0.00948 0.00658 3 11 1 5 0 1080.010 26.83 20.00 22.43 28.62 4.5 1031.70 610 -4418 4729 -2339 -5503 62 935 5008 -2034 2011 -5094 -2310 3552 -1609 -2041 436 -1410 -305 2141 992 -979 -907 -1050 457 2448 -36 1768 -358 -157 -89 2429 1639 -467 602 -3256 -2236 -3117 -928 -800 -86 -1019 -234 -928 -447 620 180 -990 1051 -745 444 228 -155 68 355 870 62 371 398 1007 -580 1029 1173 1623 2467 1055 379 379 -452 521 618 1013 -64 358 -459 -858 -435 -564 -666 -781 -1045 -873 -1213 -1577 -1383 -399 -245 -446 315 587 45 179 1033 167 -196 436 -594 -46 401 811 -38 -691 -1268 -335 -56 -813 -1284 -1009 -389 151 694 622 232 626 329 -42 482 483 264 295 -253 -291 -292 533 46 -29 633 38 1033 31 179 417 -586 -289 55 524 59 -161 35 -211 -296 -23 -134 -408 64 -547 567 -292 -644 6 98 562 -273 279 -757 -337 537 -291 -422 98 -340 -76 542 262 -271 -251 -292 131 728 -11 557 -111 -46 -26 706 516 -162 216 -1170 -766 -1119 -366 -364 -44 -572 -136 -557 -271 375 109 -604 622 -442 261 138 -100 46 248 622 45 275 296 738 -426 757 900 1316 2094 920 321 304 -355 417 535 939 -61 347 -440 -795 -378 -458 -519 -616 -888 -805 -1197 -1641 -1481 -441 -282 -535 385 720 55 209 1141 175 -200 454 -661 -55 504 1067 -51 -894 -1566 -395 -67 -1010 -1665 -1341 -529 211 1004 933 355 945 481 -58 645 639 357 414 -372 -434 -436 780 66 -41 860 50 1347 43 254 612 -882 -439 84 835 97 -271 59 -363 -504 -38 -219 -655 SS 20240523T123026.1Z 8909.521135 274 1 5.75 2 60.67 86.13 123.27 263.55 0.00 1 0.00 1 0 17 1.421e-02 6.911e-03 1.094e-02 3.976e-03 2.808268e-01 2.036886e-03 3.314648e-03 -6.000000e+00 8.232575e-03 231.63 -2.00 3.47 -2.00 316.89 0.00e+00 6.736675e-04 2.633880e-04 9.320294e-05 -6.000000e+00 3.614455e-04 285.26 -2.00 20.00 -2.00 316.13 0.00e+00 2.032 0.000 302.00 328.00 3 4.0455e+00 5.3763e-03 2.4925e-02 -6.0000e+00 2.0635e-02 1.8260e-02 6.0093e-03 1.4498e-02 -6.0000e+00 2.2305e-02 -3.5318e-03 3.5426e-03 7.0352e-03 -6.0000e+00 1.3268e-02 -2.7674e-03 1.7118e-03 1.9703e-03 -6.0000e+00 5.6270e-03 8.6490e-04 -5.4183e-04 1.1188e-04 2.1681e-05 -6.0000e+00 3.7893e-04 1.2180e-02 3.9241e-05 12 9 1 12 9 1 -18279.97 22.45 0.41 0.01218 0.00811 3 8 1 5 0 1435.850 26.83 20.01 22.45 28.96 4.5 1034.60 4097 -1186 -197 973 -4817 740 3294 -563 3886 -3515 -4122 -4293 4463 -1949 -1454 811 -1061 -322 4162 460 1812 -1284 1523 962 1880 1873 -1391 -289 -1368 -1621 753 378 1378 -1273 -2391 -2945 -3858 156 -733 -1006 -745 -43 -1545 -497 -103 -169 446 -506 -661 -571 -248 788 317 1612 419 167 813 -240 479 875 1607 1855 1697 1422 422 -137 -197 -78 1111 542 453 1242 306 326 291 -300 -837 -1474 -623 -782 -2561 -1372 -2082 -1448 -535 -607 733 261 593 893 131 678 145 75 371 -215 106 330 600 -502 -264 -984 -1003 -351 -1232 -877 -167 -303 -19 176 165 372 -51 159 387 36 631 95 113 123 -110 47 62 153 567 192 -214 888 157 660 1 75 -313 702 34 221 -93 -118 -30 -141 105 -516 -759 478 -163 -28 133 -633 86 383 -75 556 -572 -678 -710 743 -391 -328 199 -279 -87 1127 133 531 -385 449 296 604 627 -482 -96 -434 -502 236 128 497 -490 -901 -1069 -1467 64 -350 -544 -435 -26 -969 -314 -65 -106 279 -314 -406 -350 -156 519 219 1145 309 125 617 -184 361 651 1207 1450 1407 1241 377 -119 -161 -62 901 477 427 1206 301 315 272 -264 -689 -1168 -496 -670 -2407 -1368 -2185 -1559 -595 -706 877 321 732 1084 154 753 152 76 387 -239 125 415 789 -668 -340 -1209 -1184 -416 -1531 -1132 -220 -411 -27 254 247 566 -77 230 535 47 827 127 158 178 -164 70 91 219 786 259 -281 1148 211 925 1 112 -469 1068 54 359 -154 -198 -51 -237 173 -831 -1204 SS 20240523T125912.0Z 8909.541111 290 1 4.93 2 55.08 90.55 128.63 267.55 0.00 1 0.00 1 0 17 1.563e-02 8.985e-03 1.379e-02 6.400e-03 2.358985e-01 3.283436e-03 2.810890e-03 -6.000000e+00 9.056415e-03 231.63 -2.00 3.47 -2.00 316.32 0.00e+00 1.007147e-03 3.709747e-04 7.179826e-05 -6.000000e+00 3.975326e-04 285.26 -2.00 20.00 -2.00 315.58 0.00e+00 1.742 0.000 302.00 328.00 3 4.7751e+00 8.6022e-03 2.1228e-02 -6.0000e+00 2.2700e-02 7.7361e-03 9.5845e-03 1.2232e-02 -6.0000e+00 2.4534e-02 4.5661e-03 5.5463e-03 5.9255e-03 -6.0000e+00 1.4595e-02 -5.1400e-03 2.5931e-03 1.7375e-03 -6.0000e+00 6.1925e-03 5.9675e-04 -2.4078e-04 1.8003e-04 1.9299e-05 -6.0000e+00 4.1671e-04 6.9227e-03 -6.9932e-05 12 9 1 12 1 1 999.00 22.57 0.58 0.00692 0.00511 1 5 1 5 0 2464.320 26.94 20.00 22.57 29.95 4.5 1039.03 2648 501 2047 -690 -1468 -3342 -4006 -2509 -2855 3176 -5361 -4373 136 1144 -1506 -2772 5415 -1175 3727 540 1839 818 1580 1089 256 -568 -415 -998 1844 2099 -1421 385 1916 334 -5956 1027 -4708 -468 -928 387 -92 -531 422 -526 2118 -1105 -820 -1237 -1080 -1274 77 1283 -146 523 377 762 1553 -816 369 -1014 26 2117 918 2525 -457 -239 -601 -735 619 245 1634 1420 1259 -343 1586 384 -909 -949 -1507 -1254 -1204 -1170 -897 -1160 -912 -63 152 -471 882 788 -1060 495 -186 -935 250 -116 464 2164 -133 244 -1114 -367 -565 -1116 -500 -1657 -824 -914 286 731 791 333 565 154 -619 1147 -680 -269 -675 -461 151 450 733 635 765 337 132 1126 -174 1008 69 -334 -284 -57 201 -644 86 287 184 -130 207 -215 -1144 440 94 394 -132 -256 -551 -675 -458 -581 651 -1180 -950 31 287 -431 -877 1677 -393 1241 190 656 294 564 403 100 -231 -169 -395 676 744 -530 151 789 145 -2617 410 -2038 -218 -497 232 -60 -358 289 -366 1452 -774 -569 -844 -724 -849 52 905 -108 399 295 603 1240 -663 295 -810 21 1751 808 2302 -430 -216 -513 -607 519 222 1571 1415 1267 -343 1512 348 -772 -770 -1233 -1097 -1138 -1179 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