File name: Pandora32s1_GreenbeltMD_20240520_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240521T051203.5Z 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_20240520_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: 20240520 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 20240520T153711.2Z 8906.650824 358 1 33.02 2 26.51 128.98 150.63 24.30 0.00 1 0.00 1 0 17 7.602e-03 5.945e-03 1.403e-03 1.016e-03 1.693101e-01 5.292750e-04 2.023089e-03 -6.000000e+00 4.405830e-03 231.48 -2.00 3.47 -2.00 314.60 0.00e+00 1.619627e-04 4.198651e-05 2.251527e-05 -6.000000e+00 1.931276e-04 284.98 -2.00 20.00 -2.00 314.02 0.00e+00 1.117 0.000 302.00 328.00 3 4.4645e+00 1.3622e-03 1.4169e-02 -6.0000e+00 1.1040e-02 3.2819e-02 1.5052e-03 8.6675e-03 -6.0000e+00 1.1931e-02 -2.1231e-03 8.6167e-04 4.2193e-03 -6.0000e+00 7.0972e-03 -2.5420e-03 3.7625e-04 1.1630e-03 -6.0000e+00 3.0141e-03 1.6866e-03 1.1678e-04 2.8175e-05 1.5158e-05 -6.0000e+00 2.0258e-04 3.8020e-03 5.1081e-05 12 1 1 12 1 1 99.89 22.34 0.33 0.00380 0.00468 25 9 1 5 0 1269.970 26.73 20.00 22.34 29.63 4.5 1037.89 586 -1442 -21 -1428 -2240 -1497 -980 1119 814 -48 -1174 -864 28 -384 1122 59 176 399 966 1654 845 446 1187 917 448 226 240 -658 -121 -138 1227 1024 1588 -343 -2350 -1494 -1891 -1025 -403 -242 -606 -608 -513 -783 -292 -132 -703 -590 -793 -418 376 523 905 1075 497 709 922 240 463 545 937 1218 1296 1607 240 -322 -445 -725 534 458 104 -39 176 396 111 -120 -355 -824 -718 -888 -1108 -1327 -1444 -1582 -653 -690 -95 195 179 494 271 457 -128 342 655 -15 414 513 541 -163 -232 -582 -632 112 -678 -913 -685 -688 -48 275 403 376 212 436 52 379 115 53 131 151 -139 28 228 340 390 485 51 786 350 214 139 -147 -252 -126 83 -141 -24 87 110 -208 141 -290 -821 206 -572 -9 -556 -778 -503 -330 378 310 -20 -480 -343 12 -166 537 29 91 207 512 894 472 248 652 522 253 133 142 -396 -67 -71 627 554 908 -208 -1383 -818 -1080 -624 -275 -183 -484 -511 -441 -683 -252 -113 -592 -478 -650 -333 304 424 771 954 434 627 827 217 411 477 830 1136 1243 1632 249 -314 -408 -656 487 446 107 -41 187 409 114 -117 -325 -694 -630 -813 -1084 -1368 -1527 -1749 -727 -826 -115 246 220 614 316 526 -138 343 667 -16 482 604 684 -208 -281 -678 -721 129 -812 -1127 -880 -886 -64 369 566 517 293 581 66 460 137 65 164 197 -189 38 304 436 493 605 60 936 418 273 178 -193 -334 -165 115 -198 -36 125 160 -299 203 -405 -1164 SS 20240520T154131.5Z 8906.653837 361 1 49.05 2 25.86 130.76 150.30 26.26 0.00 1 0.00 1 0 17 1.154e-02 7.525e-03 4.846e-03 2.889e-03 1.766435e-01 1.489899e-03 2.112791e-03 -6.000000e+00 6.686248e-03 231.48 -2.00 3.47 -2.00 315.49 0.00e+00 4.674685e-04 1.405611e-04 5.700594e-05 -6.000000e+00 2.930378e-04 284.98 -2.00 20.00 -2.00 314.82 0.00e+00 1.111 0.000 302.00 328.00 3 6.5840e+00 3.8686e-03 1.4396e-02 -6.0000e+00 1.6754e-02 5.6070e-02 4.2929e-03 9.0819e-03 -6.0000e+00 1.8105e-02 -4.0265e-03 2.4566e-03 4.4182e-03 -6.0000e+00 1.0770e-02 -1.7486e-03 1.1042e-03 1.2372e-03 -6.0000e+00 4.5746e-03 1.9848e-04 3.6290e-04 8.1079e-05 1.5066e-05 -6.0000e+00 3.0738e-04 3.8103e-03 9.1621e-05 11 9 0 11 8 0 99.87 22.36 0.46 0.00381 0.00654 15 4 1 5 0 3269.950 26.73 20.00 22.36 29.77 4.5 1039.12 3565 -1279 -550 -1635 -4303 -760 -800 23 399 -1769 -2655 -2945 -358 -1025 848 749 -646 1806 525 2197 -116 62 1178 438 1860 -818 2257 -285 -1027 -1197 329 1129 3917 503 -4362 -2607 28 -2019 -603 -441 -1083 172 1304 -84 -1153 376 -117 81 -1319 -522 345 1130 906 706 750 28 876 617 -246 356 321 1231 1475 1331 560 -313 -523 -380 -293 827 -213 295 248 684 71 -26 -1000 -1717 -1618 -1354 -1588 -1481 -1457 -1477 -249 -570 509 100 251 58 -5 1161 -459 -419 259 -93 363 1208 941 14 -200 -1038 -634 -767 -753 -1125 -158 -639 -46 815 597 863 599 572 -360 -5 -566 -302 20 -45 -62 96 761 769 606 539 -321 228 -50 191 344 -694 -494 248 -55 -39 -138 -167 544 252 -6 -583 -693 892 -366 -161 -465 -1128 -177 -187 6 112 -536 -803 -875 -110 -349 314 300 -272 754 228 960 -53 28 526 202 886 -412 1112 -137 -465 -518 142 506 1812 247 -2149 -1201 13 -1069 -364 -302 -809 132 1013 -66 -919 295 -91 61 -976 -377 252 860 719 581 631 24 755 533 -211 302 275 1094 1385 1310 558 -299 -463 -321 -252 765 -214 308 261 706 71 -24 -863 -1397 -1308 -1173 -1499 -1499 -1551 -1622 -283 -682 631 128 323 73 -6 1311 -485 -422 263 -100 418 1478 1213 18 -251 -1239 -721 -883 -914 -1436 -207 -861 -63 1155 875 1276 871 793 -472 -6 -691 -376 26 -62 -87 136 1056 1039 792 680 -392 273 -62 246 457 -943 -674 343 -79 -58 -211 -259 845 389 -9 -868 -1014 SS 20240520T161739.5Z 8906.678930 382 1 0.84 2 21.30 148.75 146.68 41.01 0.00 1 0.00 1 0 17 8.701e-03 6.556e-03 4.437e-03 3.370e-03 1.606848e-01 1.761164e-03 1.928677e-03 -6.000000e+00 5.040393e-03 231.48 -2.00 3.47 -2.00 314.34 0.00e+00 3.063809e-04 1.333222e-04 1.308427e-05 -6.000000e+00 2.210445e-04 284.98 -2.00 20.00 -2.00 313.78 0.00e+00 1.073 0.000 302.00 328.00 3 2.9324e+00 4.5242e-03 1.3554e-02 -6.0000e+00 1.2630e-02 1.9885e-02 4.9920e-03 8.2497e-03 -6.0000e+00 1.3651e-02 6.2798e-05 2.8607e-03 4.0152e-03 -6.0000e+00 8.1203e-03 -1.9204e-03 1.2410e-03 1.1213e-03 -6.0000e+00 3.4473e-03 8.3257e-03 -3.2871e-04 9.3163e-05 1.4802e-05 -6.0000e+00 2.3190e-04 4.3155e-03 -4.6408e-05 12 9 1 12 1 1 999.00 22.51 0.27 0.00432 0.00185 2 41 1 5 0 279.050 26.83 20.00 22.51 30.18 4.4 1040.29 1778 -1169 365 -2239 -2232 -2569 -1739 979 1027 1291 -2092 46 696 -925 784 -1169 -246 -244 1961 717 2011 930 1254 1324 292 927 -189 -1478 -585 444 1374 907 1719 -242 -2053 -490 -1362 -1015 -316 -470 -206 -768 -982 -605 -481 -51 -543 -610 -1112 -346 260 45 775 1007 490 271 1078 585 455 821 492 1176 864 1883 -167 -1027 321 -429 645 1080 81 -106 -16 117 -23 -295 182 -28 2 -863 -1218 -955 -1340 -1536 -1263 -633 34 -14 51 741 191 161 153 -39 651 -112 597 579 340 -131 -286 -454 54 -23 -571 -990 -1369 -640 128 218 366 253 -124 276 249 430 -97 158 175 256 -69 21 101 327 847 619 296 869 625 -255 -222 572 323 -229 46 -405 -242 193 71 -358 -716 -55 -336 694 -498 157 -949 -874 -943 -638 377 429 560 -922 20 307 -443 398 -635 -136 -136 1098 411 1165 539 724 779 178 578 -119 -908 -340 247 762 521 1022 -149 -1241 -282 -809 -652 -224 -367 -170 -654 -850 -526 -417 -44 -465 -511 -913 -279 211 38 670 890 441 246 986 537 414 741 449 1105 848 1901 -172 -1019 298 -385 584 1038 83 -112 -17 123 -23 -287 166 -25 1 -788 -1188 -980 -1430 -1681 -1426 -741 41 -18 63 906 226 181 162 -40 670 -121 675 690 421 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