File name: Pandora32s1_GreenbeltMD_20250708_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20250709T170515.4Z 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 v1.8.75 Instrument operation file used: Pandora32_OF_v2d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20250708_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: 20250708 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 20250708T173547.1Z 9320.733184 6 1 48.68 2 17.34 198.28 151.11 78.56 0.00 1 0.00 1 0 17 8.582e-03 7.122e-03 1.397e-04 1.070e-04 1.452932e-01 5.572253e-05 1.717346e-03 -6.000000e+00 4.971676e-03 232.71 -2.00 3.47 -2.00 314.34 0.00e+00 3.986652e-04 4.292017e-06 2.685363e-05 -6.000000e+00 2.218522e-04 289.56 -2.00 20.00 -2.00 313.71 0.00e+00 1.047 0.000 302.00 328.00 3 5.5348e-01 1.4357e-04 1.2854e-02 -6.0000e+00 1.2475e-02 -9.2166e-03 1.5856e-04 7.4576e-03 -6.0000e+00 1.3484e-02 6.8884e-04 9.0759e-05 3.5921e-03 -6.0000e+00 8.0343e-03 -5.1120e-03 3.9013e-05 9.9128e-04 -6.0000e+00 3.3960e-03 9.6689e-02 1.5082e-04 2.9637e-06 1.2933e-05 -6.0000e+00 2.2907e-04 4.5665e-02 1.6802e-04 12 9 1 12 4 4 25.40 32.43 0.35 0.04566 0.04680 2667 626 1 5 0 18.220 36.46 20.15 32.43 41.22 7.1 1100.00 650 155 53 -1809 -1934 -1676 -531 906 1005 -366 -1533 -873 -553 189 650 193 253 637 908 1167 969 659 1128 880 740 582 -58 -388 -368 43 629 1100 1249 -1120 -2526 -2586 -2703 -1129 -334 -450 -646 -382 -540 -599 7 -349 -526 -633 -932 -388 275 613 876 939 728 1036 752 244 386 320 852 1360 1758 1644 483 -23 -847 -804 467 552 556 619 586 703 266 -213 -1128 -1657 -1429 -1357 -1314 -1460 -1800 -1345 -670 -296 300 564 696 788 543 62 -631 -269 -269 -94 473 740 544 202 -402 -1107 -896 -473 -998 -809 -599 -553 168 576 708 662 571 224 -181 -239 -420 -92 105 214 161 454 443 419 634 89 -9 356 56 231 68 -228 -227 18 21 52 298 259 211 68 -135 -679 -889 263 68 24 -760 -765 -612 -198 371 427 -164 -676 -376 -255 91 344 104 139 353 514 676 574 386 659 535 446 362 -36 -239 -208 25 361 624 750 -701 -1494 -1466 -1640 -740 -245 -364 -542 -332 -458 -512 6 -307 -452 -521 -774 -315 228 512 766 814 646 929 686 223 346 286 777 1315 1741 1641 481 -22 -766 -724 417 530 561 652 620 722 268 -203 -1016 -1462 -1221 -1284 -1265 -1539 -1934 -1442 -763 -347 357 693 857 936 622 70 -672 -271 -281 -103 540 889 666 245 -477 -1266 -1019 -535 -1187 -1019 -756 -726 219 788 971 911 776 292 -224 -287 -501 -110 130 285 215 599 592 536 797 107 -11 415 69 289 85 -291 -293 24 29 72 423 375 309 99 -189 -961 -1238 SS 20250708T174100.4Z 9320.736810 9 1 48.71 2 17.69 202.12 150.16 79.67 0.00 1 0.00 1 0 17 8.668e-03 7.173e-03 2.424e-04 1.746e-04 1.460037e-01 9.052517e-05 1.718820e-03 -6.000000e+00 5.026342e-03 232.71 -2.00 3.47 -2.00 314.67 0.00e+00 3.853574e-04 7.369795e-06 3.920249e-05 -6.000000e+00 2.241244e-04 289.56 -2.00 20.00 -2.00 314.00 0.00e+00 1.049 0.000 302.00 328.00 3 1.4190e+00 2.3405e-04 1.2886e-02 -6.0000e+00 1.2612e-02 -3.9343e-03 2.5892e-04 7.4775e-03 -6.0000e+00 1.3628e-02 7.5641e-04 1.4783e-04 3.6021e-03 -6.0000e+00 8.1206e-03 -5.4593e-03 6.4234e-05 9.9006e-04 -6.0000e+00 3.4366e-03 4.0466e-02 5.1886e-04 4.8718e-06 1.2728e-05 -6.0000e+00 2.3131e-04 3.9389e-02 1.9955e-04 11 9 0 11 4 0 99.99 30.53 0.31 0.03939 0.04329 2550 598 1 5 0 19.060 34.28 19.91 30.53 41.98 6.8 1100.00 778 88 122 -1725 -1937 -1457 -581 949 1018 -299 -1488 -806 -619 119 641 172 241 611 910 1126 937 724 1023 848 739 513 61 -459 -357 -77 527 984 1138 -1070 -2584 -2530 -2818 -1235 -385 -477 -602 -424 -548 -671 -19 -354 -597 -600 -964 -454 200 568 807 942 721 961 764 206 372 240 799 1368 1753 1772 587 -23 -848 -920 416 546 592 650 601 681 236 -272 -1235 -1763 -1552 -1459 -1332 -1431 -1770 -1418 -623 -232 352 659 719 854 536 106 -762 -372 -325 -170 418 746 597 227 -412 -1183 -1006 -507 -979 -817 -583 -529 177 663 798 763 630 240 -228 -326 -489 -150 73 220 160 417 410 375 537 -29 -173 249 -29 159 -2 -250 -277 16 41 150 338 328 268 129 -101 -629 -859 278 34 48 -646 -691 -478 -194 348 383 -119 -584 -308 -253 54 298 86 124 316 481 610 519 397 559 482 440 316 37 -265 -189 -38 266 522 639 -627 -1435 -1341 -1596 -745 -275 -371 -480 -351 -464 -573 -16 -298 -488 -500 -772 -355 160 479 671 813 637 859 694 188 333 214 725 1314 1705 1811 601 -21 -767 -790 369 514 611 665 619 719 235 -260 -1062 -1500 -1338 -1308 -1330 -1478 -1844 -1538 -715 -272 434 839 918 1054 616 116 -800 -368 -333 -189 481 892 758 286 -489 -1372 -1112 -578 -1158 -1026 -763 -684 236 926 1107 1062 877 310 -282 -395 -588 -188 93 288 217 564 540 497 675 -37 -206 293 -35 198 -2 -330 -369 20 57 219 484 480 396 189 -143 -909 -1221 SS 20250708T174519.0Z 9320.739803 12 1 48.72 2 18.02 205.18 149.38 80.56 0.00 1 0.00 1 0 17 8.597e-03 7.118e-03 1.428e-04 1.095e-04 1.461553e-01 5.722879e-05 1.734203e-03 -6.000000e+00 4.986766e-03 232.71 -2.00 3.47 -2.00 314.32 0.00e+00 3.849508e-04 4.382426e-06 2.752908e-05 -6.000000e+00 2.223138e-04 289.56 -2.00 20.00 -2.00 313.70 0.00e+00 1.051 0.000 302.00 328.00 3 5.9833e-01 1.4731e-04 1.2922e-02 -6.0000e+00 1.2513e-02 -9.9180e-03 1.6254e-04 7.5150e-03 -6.0000e+00 1.3519e-02 1.3224e-04 9.3143e-05 3.6243e-03 -6.0000e+00 8.0556e-03 -4.7232e-03 4.0234e-05 9.9923e-04 -6.0000e+00 3.4110e-03 9.1890e-02 7.3786e-05 3.0392e-06 1.3121e-05 -6.0000e+00 2.2942e-04 3.4500e-02 1.2103e-04 11 9 0 11 4 0 51.44 29.17 0.33 0.03450 0.03505 2463 578 1 5 0 19.730 33.16 19.95 29.17 42.52 6.7 1100.00 691 193 137 -1676 -1983 -1755 -585 769 1099 -208 -1498 -973 -606 181 658 292 212 580 915 1135 1044 629 1064 918 766 615 11 -391 -379 -81 568 982 1330 -855 -2503 -2607 -2782 -1204 -373 -401 -627 -432 -489 -601 -21 -307 -524 -665 -952 -513 190 597 822 959 711 987 775 241 353 259 792 1288 1724 1716 647 20 -766 -868 319 599 527 645 571 683 306 -197 -1105 -1683 -1526 -1361 -1333 -1408 -1789 -1422 -697 -336 297 563 704 815 540 154 -653 -314 -264 -107 399 723 594 206 -312 -1069 -976 -476 -940 -847 -603 -560 62 565 698 706 616 277 -151 -246 -411 -121 67 219 151 450 406 392 577 171 -80 303 61 197 87 -221 -254 -7 14 69 256 294 222 71 -113 -648 -897 278 85 61 -711 -794 -645 -218 314 465 -94 -665 -421 -279 86 348 157 117 323 520 661 621 371 624 559 462 384 7 -244 -217 -46 327 559 801 -538 -1499 -1488 -1688 -785 -273 -324 -528 -361 -418 -517 -18 -260 -454 -553 -761 -420 159 501 722 836 636 892 712 222 320 233 727 1197 1714 1722 652 19 -704 -791 286 576 534 685 611 711 314 -191 -1012 -1432 -1311 -1231 -1287 -1428 -1935 -1536 -798 -396 356 697 875 982 629 170 -678 -320 -277 -117 458 872 733 253 -376 -1243 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