File name: Pandora32s1_GreenbeltMD_20250313_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20250314T052125.9Z 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 v1.8.74 Instrument operation file used: Pandora32_OF_v2d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20250313_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: 20250313 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 20250313T201850.2Z 9203.846414 558 1 49.19 2 58.97 236.32 117.08 57.95 0.00 1 0.00 1 0 17 1.959e-02 6.346e-03 7.236e-03 2.522e-03 2.611346e-01 1.264813e-03 3.105204e-03 -6.000000e+00 1.113873e-02 226.27 -2.00 3.47 -2.00 317.05 0.00e+00 1.008452e-03 1.688925e-04 7.012959e-05 -6.000000e+00 4.832232e-04 277.95 -2.00 20.00 -2.00 316.42 0.00e+00 1.932 0.000 302.00 328.00 3 5.5091e+00 3.3127e-03 2.3212e-02 -6.0000e+00 2.7634e-02 3.6679e-02 3.7175e-03 1.3231e-02 -6.0000e+00 3.0009e-02 -7.3170e-03 2.2219e-03 6.5149e-03 -6.0000e+00 1.7852e-02 -9.7205e-04 1.0905e-03 2.0512e-03 -6.0000e+00 7.6187e-03 2.2824e-04 7.4780e-04 7.1551e-05 2.1686e-05 -6.0000e+00 5.2122e-04 5.5256e-04 7.4482e-05 11 1 0 11 8 0 99.98 21.00 0.24 0.00055 0.00617 17 4 1 5 0 2893.240 26.00 20.08 21.00 16.22 5.6 960.07 10861 -2971 -2440 -5428 -3480 -11417 4558 -1446 -2105 2134 -7203 -3071 -1509 -1131 3359 -1144 -607 -310 1778 542 930 -101 1763 1535 -215 456 -139 559 -14 -1411 772 -1108 4950 124 -2533 -279 -4189 -1096 -1307 383 -334 -1117 723 -494 880 658 206 785 -40 495 -315 431 391 1298 344 547 1182 -443 256 181 435 1102 1199 1243 -304 -181 -244 -1272 858 1085 101 -867 36 374 -119 -438 -719 -1383 -1167 -909 -637 -1449 -974 -1815 -563 -1024 425 459 93 708 129 1084 -89 -118 1236 -40 693 513 877 -470 -133 -512 -1141 160 -698 -527 -393 -543 -21 288 269 342 295 344 245 87 -45 -161 88 -32 -299 59 415 5 422 191 -282 511 190 367 194 -159 -397 -215 454 -315 -71 -86 322 273 -28 -20 -878 1148 -402 -343 -763 -434 -1414 495 -183 -300 312 -1150 -472 -248 -211 686 -270 -151 -79 464 148 260 -28 487 442 -66 145 -45 173 -4 -405 224 -351 1609 44 -889 -92 -1477 -424 -591 196 -188 -663 434 -304 536 402 125 466 -23 289 -190 274 261 897 247 398 870 -331 188 131 320 844 979 1074 -270 -155 -195 -987 673 927 94 -846 35 359 -110 -378 -573 -1050 -891 -751 -575 -1420 -1006 -1948 -626 -1198 513 570 116 870 152 1198 -93 -118 1256 -44 812 645 1161 -632 -172 -627 -1337 188 -864 -683 -524 -746 -30 423 411 531 452 506 341 116 -60 -216 123 -47 -449 88 610 8 587 257 -369 658 254 515 283 -237 -599 -332 722 -521 -120 -147 553 466 -46 -32 -1412 SS 20250313T202803.7Z 9203.852821 564 1 48.80 2 60.48 238.34 115.63 59.82 0.00 1 0.00 1 0 17 1.205e-02 5.217e-03 5.293e-03 1.773e-03 2.704173e-01 8.894563e-04 3.206848e-03 -6.000000e+00 6.850409e-03 226.27 -2.00 3.47 -2.00 317.12 0.00e+00 6.240135e-04 1.209605e-04 5.739718e-05 -6.000000e+00 2.973325e-04 277.95 -2.00 20.00 -2.00 316.49 0.00e+00 2.020 0.000 302.00 328.00 3 4.7723e+00 2.3325e-03 2.4174e-02 -6.0000e+00 1.6995e-02 2.1352e-02 2.6184e-03 1.3626e-02 -6.0000e+00 1.8458e-02 -4.1730e-03 1.5732e-03 6.7325e-03 -6.0000e+00 1.0980e-02 -2.2456e-03 7.7608e-04 1.9800e-03 -6.0000e+00 4.6843e-03 4.3497e-04 1.3358e-04 5.0205e-05 2.1420e-05 -6.0000e+00 3.2073e-04 9.8106e-04 -2.0196e-05 10 0 0 10 0 0 99.85 21.04 0.36 0.00098 0.00198 36 8 1 5 0 1355.380 26.00 20.11 21.04 16.58 5.6 962.59 4368 -4541 -2216 -2216 -2401 -4956 -612 2595 -2215 -2238 -3180 -2719 -219 -1391 2495 -103 -598 -453 62 2711 1170 407 2365 405 958 -48 255 -1185 -556 -251 -565 623 2687 200 -2948 -689 -2495 -855 -327 24 -538 -363 -424 -1016 121 132 -479 -250 -729 -722 777 982 1028 796 453 704 607 64 414 592 1019 1448 1075 849 35 -139 -6 -212 229 940 -54 37 126 401 -270 -385 -604 -882 -957 -611 -914 -1020 -1560 -1494 -837 -675 -16 312 304 503 395 1194 49 347 569 412 175 447 592 -353 -324 -779 -689 126 -365 -1024 -410 -558 -356 172 92 362 94 252 102 -37 479 185 87 206 -146 161 165 222 301 256 -15 621 411 163 103 -268 -333 -85 207 67 -71 122 -25 23 -50 -185 -593 462 -585 -293 -285 -281 -548 -66 301 -302 -326 -470 -400 -34 -251 495 -23 -143 -112 16 701 316 110 631 115 285 -15 80 -366 -160 -70 -163 191 875 70 -1025 -224 -857 -325 -144 12 -298 -211 -253 -617 73 79 -289 -148 -426 -420 461 616 677 547 322 508 445 47 302 426 741 1098 871 727 31 -118 -5 -163 180 802 -50 35 123 382 -248 -332 -480 -668 -732 -506 -829 -997 -1614 -1597 -927 -783 -19 386 378 615 464 1317 51 348 583 450 206 563 784 -474 -421 -958 -809 147 -452 -1330 -546 -765 -502 252 141 560 145 371 143 -50 629 249 122 303 -220 241 243 320 421 347 -19 804 551 230 151 -403 -506 -132 332 112 -120 209 -44 39 -84 -303 -956 SS 20250313T203233.0Z 9203.855937 567 1 2.90 2 61.22 239.30 114.91 60.71 0.00 1 0.00 1 0 17 1.472e-02 6.915e-03 1.291e-02 4.945e-03 2.762723e-01 2.487797e-03 3.315280e-03 -6.000000e+00 8.361538e-03 226.27 -2.00 3.47 -2.00 316.79 0.00e+00 8.023697e-04 3.108834e-04 5.451637e-05 -6.000000e+00 3.630849e-04 277.95 -2.00 20.00 -2.00 316.16 0.00e+00 2.067 0.000 302.00 328.00 3 3.7215e+00 6.4900e-03 2.4753e-02 -6.0000e+00 2.0743e-02 1.0514e-02 7.2680e-03 1.3980e-02 -6.0000e+00 2.2533e-02 -9.4534e-03 4.2986e-03 6.9038e-03 -6.0000e+00 1.3404e-02 7.6947e-04 2.0869e-03 2.0335e-03 -6.0000e+00 5.7162e-03 1.1852e-03 -4.3926e-04 1.3897e-04 2.2787e-05 -6.0000e+00 3.9170e-04 1.5294e-03 -1.1602e-04 12 9 1 12 1 1 999.00 21.07 0.27 0.00153 -0.00177 2 12 1 5 0 963.930 26.00 19.93 21.07 16.78 5.5 963.10 6971 -4674 -3249 -6309 -3397 -2382 770 -1661 -32 -705 -796 1236 5578 1314 755 54 -2038 3812 1277 761 876 -246 1079 -197 3025 -257 -52 -2372 537 238 3270 437 1019 -930 -1899 -1633 -1468 -1294 -767 -258 -1715 -1923 -1183 -130 666 -112 -236 -1108 -913 103 1649 144 388 1410 405 641 1033 -169 280 -94 243 1596 1598 1222 325 -557 -831 217 -466 1262 241 412 459 1004 520 -576 -98 -676 267 -185 -570 -967 -1823 -1504 -1197 -1471 163 -404 503 489 479 687 -209 509 1167 544 130 1212 -101 -506 -402 -1116 255 -2 -41 -1571 -1264 -680 -352 457 342 322 635 196 -105 499 -79 699 -38 -195 -544 201 522 42 911 129 -159 471 451 91 -321 8 204 -338 273 -53 4 137 -230 27 -86 5 -627 850 -708 -508 -988 -472 -304 98 -236 -5 -118 -135 206 969 269 176 14 -564 1040 369 228 269 -76 331 -63 995 -90 -18 -828 174 75 1037 152 379 -367 -733 -603 -561 -550 -372 -141 -1024 -1198 -750 -83 423 -72 -150 -700 -569 64 1035 96 270 1013 301 482 787 -130 213 -71 185 1254 1329 1071 292 -487 -688 173 -383 1104 227 402 451 969 486 -510 -81 -536 212 -158 -529 -961 -1910 -1619 -1335 -1714 195 -497 619 595 561 765 -221 519 1211 599 153 1510 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