File name: Pandora32s1_GreenbeltMD_20230827_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240223T221841.6Z 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_20230827_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: 20230827 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 20230827T113655.3Z 8639.483974 86 1 48.84 2 78.30 86.47 151.38 282.94 0.00 1 0.00 1 0 25 3.371e-01 7.756e-03 1.071e-01 2.419e-03 5.784668e-01 1.271517e-03 6.624839e-03 -6.000000e+00 1.943020e-01 230.73 -2.00 3.47 -2.00 320.49 0.00e+00 2.903760e-03 5.018324e-04 1.288240e-03 -6.000000e+00 8.741439e-03 290.10 -2.00 20.00 -2.00 319.76 0.00e+00 4.770 0.002 302.00 328.00 3 2.2044e+00 3.9972e-03 5.6183e-02 -6.0000e+00 4.8510e-01 3.6748e-02 5.1023e-03 3.0815e-02 -6.0000e+00 5.2466e-01 -6.7334e-02 4.5815e-03 1.5924e-02 -6.0000e+00 3.1327e-01 2.1279e-02 2.2936e-03 5.1486e-03 -6.0000e+00 1.3342e-01 2.8451e-04 -5.1244e-04 6.6940e-05 6.0379e-05 -6.0000e+00 8.9914e-03 2.7716e-02 8.5314e-05 11 9 0 11 8 0 98.72 26.67 0.53 0.02772 0.02387 67 16 1 5 0 728.860 31.10 25.02 26.67 26.31 3.3 1003.36 -100129 -100117 -74506 -87921 -50730 -157875 227466 -85070 -79813 -40580 -87025 -94434 -59778 -19834 4087 -25520 -29907 -6897 14169 26445 -18069 -24460 1348 -21873 -3613 -12419 -4734 17301 -9612 -25352 -321 -16131 8862 -14272 74 -2471 -10933 -4654 -8498 5765 -1073 3560 -5368 5312 4219 4605 3762 6198 2970 -3698 -703 7360 4826 4592 272 2115 1274 -255 1081 1491 2974 3016 2805 1994 1219 198 931 2214 1102 1682 65 -987 520 134 -450 -1687 -411 -1338 -1460 -417 -1431 -864 -1828 -1671 213 -534 -181 -182 775 699 943 274 -559 -214 -360 250 162 717 -130 -543 -327 -1299 -893 -449 -1486 -617 -996 -65 -18 544 132 527 292 254 942 35 372 -172 -36 -104 -361 351 348 373 244 -30 122 742 128 311 109 -276 -483 367 -161 89 -49 -257 8 18 151 -248 -219 -1085 -1302 -830 -1114 -416 -3480 537 -1125 -1148 -437 -1531 -1946 -1075 -309 63 -627 -869 -177 324 572 -622 -900 40 -874 -132 -526 -191 557 -390 -1244 -14 -984 495 -1076 5 -159 -819 -385 -887 629 -141 484 -835 771 631 700 588 970 496 -690 -140 1510 1104 1137 74 591 371 -76 311 421 849 932 969 770 501 81 366 871 472 811 35 -562 293 73 -231 -801 -179 -581 -685 -223 -883 -593 -1368 -1315 174 -465 -165 -170 721 638 816 225 -442 -170 -308 238 172 837 -164 -695 -401 -1488 -955 -479 -1688 -732 -1231 -83 -25 796 207 860 480 407 1440 51 551 -264 -57 -173 -603 573 554 579 370 -44 175 1077 201 528 197 -520 -938 737 -340 194 -109 -579 18 41 324 -513 -444 SS 20230827T120937.2Z 8639.506680 102 1 48.56 2 71.95 91.59 157.09 291.60 0.00 1 0.00 1 0 17 3.172e-02 5.236e-03 4.577e-03 5.775e-04 4.006801e-01 2.942279e-04 4.668455e-03 -6.000000e+00 1.827919e-02 230.73 -2.00 3.47 -2.00 318.67 0.00e+00 8.489086e-04 6.383345e-05 2.600734e-04 -6.000000e+00 8.223473e-04 290.10 -2.00 20.00 -2.00 317.80 0.00e+00 3.184 0.001 302.00 328.00 3 1.3080e+00 8.1141e-04 3.7812e-02 -6.0000e+00 4.5636e-02 -2.1868e-03 9.3176e-04 2.0845e-02 -6.0000e+00 4.9357e-02 -1.0811e-02 6.3716e-04 1.0125e-02 -6.0000e+00 2.9471e-02 -4.6493e-04 3.3484e-04 2.8484e-03 -6.0000e+00 1.2552e-02 3.8344e-03 -2.7333e-04 1.6312e-05 2.9282e-05 -6.0000e+00 8.4587e-04 2.7282e-02 7.5205e-05 10 0 0 10 0 0 97.57 26.75 0.30 0.02728 0.02523 410 96 1 5 0 118.420 31.19 24.99 26.75 27.40 3.3 1009.17 -10218 -9939 -9918 -10275 -12272 -15750 -5918 -10083 -6167 -8760 -11683 -7303 -5202 -1825 -205 -114 -1180 626 924 1199 904 -2 739 -364 -341 -745 -780 -1184 -1959 -1556 -633 381 733 -1896 -2815 -2760 -3098 -1408 -701 -87 -704 -176 -984 -485 297 322 97 -75 -424 -388 587 1128 1147 1338 757 1132 774 70 168 464 1155 1537 1888 1663 548 299 133 291 1064 718 208 178 -64 162 -214 -422 -664 -956 -760 -837 -1256 -1239 -1867 -1480 -790 -608 156 219 262 489 607 423 61 538 477 292 392 387 -49 -395 -478 -993 -429 -18 -931 -1054 -711 -540 28 410 261 270 246 289 286 466 294 234 12 -226 -379 39 105 232 470 242 205 944 448 192 176 -174 -100 99 -40 -135 35 72 -107 -189 3 -339 -294 -349 -392 -416 -423 -467 -585 -209 -423 -284 -448 -628 -392 -315 -129 -17 -11 -124 69 108 147 115 0 97 -47 -48 -111 -118 -173 -273 -215 -94 64 137 -390 -562 -531 -640 -336 -187 -27 -252 -67 -393 -197 120 132 40 -31 -175 -164 243 510 560 697 416 640 422 39 97 264 667 889 1206 1165 377 210 88 188 730 529 172 146 -52 136 -168 -300 -457 -632 -530 -626 -1083 -1129 -1757 -1465 -829 -647 175 254 306 553 640 434 58 528 472 325 466 491 -65 -524 -628 -1194 -502 -21 -1136 -1374 -922 -736 40 612 402 431 386 450 413 661 415 344 18 -346 -592 62 162 346 700 345 279 1281 661 298 280 -290 -171 169 -73 -251 67 135 -203 -362 6 -619 -522 SS 20230827T121916.3Z 8639.513383 108 1 48.56 2 70.08 93.14 158.71 294.78 0.00 1 0.00 1 0 17 1.969e-02 5.304e-03 2.489e-03 4.411e-04 3.666374e-01 2.245546e-04 4.289305e-03 -6.000000e+00 1.135044e-02 230.73 -2.00 3.47 -2.00 318.18 0.00e+00 7.799881e-04 4.202540e-05 1.843947e-04 -6.000000e+00 5.106393e-04 290.10 -2.00 20.00 -2.00 317.31 0.00e+00 2.903 0.000 302.00 328.00 3 1.1273e+00 6.0905e-04 3.4491e-02 -6.0000e+00 2.8338e-02 -2.1719e-03 6.9250e-04 1.9020e-02 -6.0000e+00 3.0649e-02 -9.9252e-03 4.4790e-04 9.2311e-03 -6.0000e+00 1.8300e-02 -2.3760e-04 2.3199e-04 2.5925e-03 -6.0000e+00 7.7942e-03 6.2750e-03 -2.9833e-04 1.2479e-05 2.7441e-05 -6.0000e+00 5.2526e-04 2.7232e-02 6.5010e-05 10 0 0 10 0 0 87.99 26.79 0.32 0.02723 0.02499 517 121 1 5 0 93.910 31.19 25.00 26.79 27.97 3.3 1013.10 -5653 -5544 -4117 -7079 -7477 -9275 -6059 -4582 -3991 -4753 -6908 -5075 -2969 -1258 -139 176 -355 370 1023 1022 640 242 763 196 89 -290 -657 -1216 -1546 -861 593 643 1380 -1318 -2650 -2680 -2750 -820 -172 -262 -779 -365 -692 -344 196 -3 -242 34 -329 -155 622 1031 1088 1239 814 1015 759 164 298 444 1118 1385 1689 1575 379 125 32 -3 892 751 216 118 -72 172 -96 -286 -712 -932 -724 -832 -1106 -1308 -1943 -1540 -777 -529 -2 115 279 398 496 516 46 614 388 242 425 463 -5 -357 -529 -897 -435 32 -852 -1029 -638 -580 109 350 225 222 257 249 268 511 323 306 77 -195 -421 29 202 212 499 282 227 1081 434 203 72 -212 -107 129 -6 -115 -20 94 -72 -164 -95 -425 -317 -284 -319 -247 -426 -407 -483 -320 -270 -266 -344 -519 -387 -253 -125 -16 23 -47 52 150 157 102 39 124 34 17 -57 -132 -236 -284 -156 114 139 329 -343 -670 -652 -715 -226 -57 -104 -323 -160 -317 -160 91 -2 -114 16 -153 -73 310 557 591 715 493 633 487 106 189 278 710 884 1186 1206 284 95 23 -2 652 590 190 103 -64 146 -81 -217 -521 -651 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