File name: Pandora32s1_GreenbeltMD_20230924_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240223T220125.3Z 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_20230924_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: 20230924 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 20230924T195321.9Z 8667.828725 350 1 29.90 2 56.14 235.98 97.06 118.38 0.00 1 0.00 1 0 17 8.414e-03 5.890e-03 1.593e-03 8.684e-04 2.222466e-01 4.431198e-04 2.655389e-03 -6.000000e+00 4.824566e-03 228.32 -2.00 3.47 -2.00 315.84 0.00e+00 3.858779e-04 4.584732e-05 5.032801e-05 -6.000000e+00 2.161712e-04 287.66 -2.00 20.00 -2.00 315.11 0.00e+00 1.789 0.000 302.00 328.00 3 3.3251e+00 1.1453e-03 2.1004e-02 -6.0000e+00 1.1986e-02 2.1894e-02 1.2766e-03 1.1297e-02 -6.0000e+00 1.2974e-02 -1.2272e-03 7.3540e-04 5.5179e-03 -6.0000e+00 7.7510e-03 -3.0895e-03 3.3866e-04 1.5527e-03 -6.0000e+00 3.3258e-03 2.5087e-03 1.2595e-04 2.4341e-05 1.8643e-05 -6.0000e+00 2.2403e-04 -2.6594e-03 3.7743e-05 12 1 1 12 1 1 99.86 22.13 0.28 -0.00266 -0.00171 60 23 1 5 0 490.000 26.51 20.00 22.13 26.35 3.4 1003.44 -400 -1490 -308 -1836 -2577 -2291 -1376 264 561 -755 -1987 -1408 26 -164 1148 824 22 731 959 1363 1330 460 931 926 708 374 5 -775 -312 -53 803 652 1598 -131 -2397 -2248 -2322 -1078 -522 -182 -565 -547 -394 -540 -105 -84 -409 -389 -722 -623 204 887 747 1084 714 798 938 149 613 453 857 1340 1455 1483 518 -179 -422 -729 315 874 175 335 237 414 184 -133 -684 -1151 -1093 -660 -1129 -1213 -1682 -1791 -821 -646 -286 215 187 533 358 543 -248 142 265 121 343 564 469 -9 -350 -714 -640 -178 -642 -869 -612 -585 -106 485 396 480 284 484 99 176 -37 52 -25 92 -45 228 291 237 447 495 -98 739 483 108 221 -282 -309 36 116 -48 -17 224 119 -186 -62 -476 -691 -87 -368 -78 -459 -578 -466 -280 58 140 -205 -546 -379 7 -49 386 286 8 275 373 545 548 190 383 395 321 166 2 -360 -134 -22 328 286 750 -61 -1104 -1041 -1117 -547 -296 -115 -398 -385 -285 -398 -77 -61 -295 -289 -521 -442 148 643 576 875 567 646 774 124 501 365 698 1150 1286 1404 506 -166 -374 -611 268 788 169 342 245 418 185 -122 -593 -974 -924 -579 -1068 -1212 -1821 -1943 -935 -756 -341 265 234 649 428 617 -269 144 274 130 408 708 610 -12 -441 -866 -756 -210 -786 -1097 -807 -772 -145 674 582 696 418 665 130 223 -48 66 -34 128 -63 321 414 326 607 639 -125 916 629 145 302 -397 -441 51 173 -74 -26 359 186 -289 -97 -717 -1051 SS 20230924T203529.8Z 8667.857983 378 1 48.71 2 63.28 244.97 90.30 124.49 0.00 1 0.00 1 0 17 1.343e-02 6.245e-03 7.752e-03 2.396e-03 2.741569e-01 1.211402e-03 3.260269e-03 -6.000000e+00 7.698575e-03 228.32 -2.00 3.47 -2.00 317.26 0.00e+00 8.878009e-04 1.759112e-04 1.544036e-04 -6.000000e+00 3.450164e-04 287.66 -2.00 20.00 -2.00 316.45 0.00e+00 2.211 0.000 302.00 328.00 3 5.1140e+00 3.1976e-03 2.5985e-02 -6.0000e+00 1.9126e-02 4.3158e-02 3.5963e-03 1.4035e-02 -6.0000e+00 2.0703e-02 2.5294e-03 2.1625e-03 6.8724e-03 -6.0000e+00 1.2369e-02 -6.7942e-03 1.0761e-03 1.9927e-03 -6.0000e+00 5.3065e-03 2.5196e-04 -7.1630e-05 6.7954e-05 2.1412e-05 -6.0000e+00 3.5756e-04 -2.3271e-03 9.9195e-06 10 0 0 10 0 0 97.43 22.20 0.49 -0.00233 -0.00287 17 4 1 5 0 2865.050 26.62 20.00 22.20 26.75 3.3 1003.74 2047 -2233 -1870 -1996 -4135 17 4540 1799 2473 -3405 -2845 -3806 2675 866 1435 1442 -3699 649 -1261 4140 1207 -1324 1506 -1008 315 619 1204 -521 -668 -2753 2318 -869 -126 502 -3056 -2747 -3164 -1825 -1677 616 -1188 -297 -535 -295 -212 806 416 695 -812 -127 -279 471 804 1532 1348 659 195 353 419 444 789 1699 1581 1621 641 -515 -748 354 -415 1138 -128 119 194 71 -70 -528 -542 -1242 -897 -1115 -1078 -1024 -1403 -1802 -418 -371 234 206 352 831 452 68 3 -521 536 62 160 1009 444 31 81 -1154 -1173 -705 -884 -1235 -558 -386 110 510 150 742 579 293 205 30 -64 -381 429 94 5 169 427 232 191 85 102 511 273 287 35 -418 -358 -152 -3 147 -42 -154 421 179 -56 -180 -770 200 -256 -225 -236 -452 2 428 192 296 -461 -387 -522 375 141 267 299 -853 149 -307 995 307 -345 383 -273 89 182 357 -152 -184 -747 619 -258 -40 168 -1023 -873 -1046 -672 -719 299 -642 -167 -311 -174 -125 472 243 398 -464 -72 -163 290 520 1028 934 468 141 256 301 314 565 1266 1257 1364 555 -435 -592 268 -324 958 -117 114 187 68 -64 -452 -429 -935 -679 -914 -969 -992 -1443 -1923 -461 -429 281 255 438 1017 531 76 3 -524 547 68 188 1264 589 42 105 -1428 -1382 -831 -1095 -1607 -746 -531 156 747 229 1153 891 435 288 41 -85 -517 602 138 7 255 633 336 269 117 135 664 367 406 52 -631 -547 -237 -5 245 -72 -267 732 309 -95 -297 -1252 SS 20230924T205241.4Z 8667.869924 388 1 12.09 2 66.35 248.30 87.68 127.12 0.00 1 0.00 1 0 17 1.878e-02 6.307e-03 1.049e-02 3.088e-03 3.055817e-01 1.562466e-03 3.636762e-03 -6.000000e+00 1.076690e-02 228.31 -2.00 3.47 -2.00 317.36 0.00e+00 5.183769e-04 2.332243e-04 1.615616e-04 -6.000000e+00 4.825789e-04 287.66 -2.00 20.00 -2.00 316.55 0.00e+00 2.474 0.000 302.00 328.00 3 3.9466e+00 4.1312e-03 2.9050e-02 -6.0000e+00 2.6749e-02 3.0096e-02 4.6497e-03 1.5661e-02 -6.0000e+00 2.8955e-02 -7.3600e-03 2.8174e-03 7.6576e-03 -6.0000e+00 1.7298e-02 -1.0264e-03 1.4116e-03 2.1520e-03 -6.0000e+00 7.4217e-03 6.0560e-04 -2.2108e-04 8.6921e-05 2.3568e-05 -6.0000e+00 5.0012e-04 -3.8805e-03 -5.8674e-05 12 1 1 12 1 1 68.82 22.21 0.24 -0.00388 -0.00554 6 7 1 5 0 1726.170 26.62 20.00 22.21 27.23 3.4 1006.71 -1842 -992 -506 -3944 -5102 -9837 -9036 -7917 -1474 -1068 -5692 -4895 -1324 -285 -2691 2902 119 1878 1770 2773 2232 -1069 1621 -912 1257 862 1768 200 -325 168 1859 -363 516 -1959 -3802 -2653 -1833 -1868 157 375 -1370 36 226 -691 299 -580 -36 581 -418 -401 504 1007 1706 1342 150 982 555 31 1472 -35 808 848 1885 1715 315 390 -69 71 -152 481 266 656 -411 -251 -62 -486 -1071 -1845 -1518 -787 -1576 -575 -855 -1990 -702 -876 -263 -29 734 145 814 675 -522 -75 275 221 511 580 765 -187 -264 -1050 -867 -113 -591 -1023 -515 -256 -100 165 748 437 466 253 84 130 604 -390 235 109 -384 266 313 266 851 245 -335 469 223 208 135 -152 -119 -208 -43 -101 -18 -120 248 -322 138 -163 -517 -166 -101 -54 -427 -509 -949 -883 -847 -168 -130 -734 -630 -180 -44 -487 560 25 405 400 644 538 -265 394 -236 339 244 504 56 -86 43 489 -105 161 -659 -1268 -839 -596 -681 65 178 -721 20 127 -396 171 -335 -20 327 -235 -225 290 612 1084 891 103 687 397 22 1039 -25 573 626 1470 1418 269 323 -54 54 -119 406 242 619 -394 -237 -56 -415 -855 -1415 -1174 -652 -1432 -557 -876 -2119 -771 -1006 -313 -36 895 175 945 746 -547 -76 285 243 601 728 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