File name: Pandora32s1_GreenbeltMD_20241205_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20241206T052035.7Z 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 v1.8.60 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20241205_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: 20241205 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 20241205T140230.6Z 9105.585077 95 1 50.26 2 73.93 138.15 112.83 102.55 0.00 1 0.00 1 0 17 5.055e-01 3.801e-02 3.005e-01 2.003e-02 5.347597e-01 1.101196e-02 6.070700e-03 -6.000000e+00 2.948353e-01 223.27 -2.00 3.47 -2.00 320.48 0.00e+00 -8.367526e-03 4.281103e-03 1.013662e-03 -6.000000e+00 1.687661e-02 279.28 -2.00 20.00 -2.00 319.93 0.00e+00 3.553 0.001 302.00 328.00 3 6.5111e+00 3.3797e-02 4.5442e-02 -6.0000e+00 7.2525e-01 -8.9510e-02 4.3833e-02 3.0949e-02 -6.0000e+00 7.9485e-01 1.4622e-01 4.3553e-02 1.5810e-02 -6.0000e+00 4.6448e-01 -5.2648e-02 2.1781e-02 1.0463e-02 -6.0000e+00 2.1143e-01 1.2582e-05 9.5532e-04 6.1836e-04 7.6985e-05 -6.0000e+00 1.4361e-02 5.7284e-04 1.4237e-05 12 8 8 10 0 0 99.99 20.06 1.26 0.00057 0.00775 14 3 1 5 0 3589.530 25.28 19.28 20.06 8.63 5.3 913.12 900000 900000 900000 900000 900000 900000 900000 -138699 900000 900000 86015 -16566 900000 900000 900000 900000 -115618 51403 -35730 900000 -12004 -34508 900000 -29205 900000 -36405 900000 119158 -30112 -33959 900000 97403 30127 411300 -21588 -27967 147573 57586 -1187 61717 29436 40286 111741 35360 -689 65436 3985 38744 49595 9145 5497 -3222 7856 6801 1903 12238 -13552 1445 -6057 -1187 7665 -20828 -6 -11244 -2557 1391 6029 14198 2590 17876 -891 -3996 88 4024 -5395 -10883 7040 -2172 -8078 -11014 -9596 9288 -7867 -2959 181 680 15617 -6292 5733 -2540 4653 10826 -32 -4132 854 5624 477 4504 5962 -3691 3821 -6171 -4403 -4680 -3679 1015 -534 2700 -626 538 -2228 1720 5 -2318 4707 -3715 1561 -774 4436 -3953 3118 -887 118 -171 269 1468 1780 -2798 1497 1051 -1695 3006 -2248 -654 586 2294 -1894 -3905 1966 819 1829 115 -866 900000 900000 900000 900000 900000 900000 900000 -3013 900000 900000 1674 -322 900000 900000 900000 900000 -6867 1000 -1197 900000 -361 -1308 900000 -1257 900000 -2124 900000 2319 -1585 -1832 900000 1956 1286 8005 -1607 -2157 2872 2572 -112 4015 2964 3994 6026 3905 -106 5491 591 4197 4985 1392 941 -666 1611 1531 481 2978 -4409 416 -1835 -334 1991 -7494 -2 -4555 -1010 521 2075 4548 994 6794 -451 -2207 47 2017 -2754 -5307 2658 -868 -3600 -5775 -5726 5257 -5747 -2193 138 552 11649 -5952 4862 -2267 3655 7504 -23 -3079 653 4619 464 4723 6722 -4623 4257 -6872 -4431 -4701 -3904 1096 -610 3152 -804 746 -3448 2701 8 -3659 6579 -5310 2094 -1094 6297 -6358 4750 -1369 174 -246 371 1926 2229 -3668 2047 1596 -2849 5091 -4121 -1236 1160 4700 -4123 -8772 4216 1731 3657 221 -1624 SS 20241205T142458.7Z 9105.600679 104 1 0.99 2 71.16 142.75 108.73 105.54 0.00 1 0.00 1 0 17 4.207e-02 6.845e-03 3.827e-02 4.400e-03 4.389370e-01 2.191808e-03 5.163790e-03 -6.000000e+00 2.364851e-02 223.27 -2.00 3.47 -2.00 318.65 0.00e+00 1.216123e-03 4.731688e-04 2.108838e-04 -6.000000e+00 1.043427e-03 279.28 -2.00 20.00 -2.00 318.02 0.00e+00 3.059 0.000 302.00 328.00 3 1.4571e+00 5.9204e-03 3.7327e-02 -6.0000e+00 5.8246e-02 1.2530e-02 6.7959e-03 2.1990e-02 -6.0000e+00 6.3375e-02 -1.6640e-02 4.9010e-03 1.1079e-02 -6.0000e+00 3.7816e-02 4.8686e-03 2.6206e-03 3.4187e-03 -6.0000e+00 1.6261e-02 3.4987e-03 -3.6737e-04 1.2164e-04 3.5494e-05 -6.0000e+00 1.1186e-03 -1.6098e-03 -4.2585e-05 12 9 1 12 1 1 94.18 20.08 0.26 -0.00161 -0.00437 5 69 1 5 0 164.890 25.28 18.92 20.08 7.96 5.2 908.80 330 -11034 -13535 -14959 -8554 -20257 -13856 3761 -11544 -4405 -20106 -14307 -9410 -3045 -2613 -4236 -4543 -6219 -1107 3611 -1255 -2594 -2206 -412 -1835 -1242 981 -5087 856 -1148 -4844 2252 2125 -1385 -5804 -1864 -1634 -3324 2579 -192 1231 -1271 -1114 -624 687 2513 1977 2697 -1154 485 -935 1898 1660 1307 811 -90 2497 114 228 1196 278 1749 2638 1362 1224 -334 712 -1098 -410 1090 -748 568 -686 199 955 -1380 -1288 -1405 -441 -480 -854 -1040 -1529 -1699 -1364 -1432 249 248 -503 729 1077 800 389 113 340 -306 250 1063 476 71 -1096 -657 -266 -355 -212 -1147 -937 -939 22 397 239 725 372 197 459 365 164 431 -124 -343 -396 296 723 129 414 -395 58 499 401 287 326 -168 -358 281 -166 -23 -135 196 33 -257 -174 -118 -352 9 -390 -529 -591 -294 -725 -483 124 -499 -194 -1058 -741 -529 -194 -199 -379 -449 -666 -120 395 -149 -312 -268 -52 -253 -180 143 -766 117 -159 -744 367 388 -281 -1202 -358 -327 -767 667 -59 418 -469 -426 -243 267 968 770 1047 -465 197 -403 864 806 672 436 -50 1393 65 128 656 155 1016 1642 920 862 -233 473 -728 -281 807 -606 474 -583 165 751 -1030 -897 -948 -304 -363 -714 -944 -1478 -1705 -1420 -1558 278 284 -582 826 1171 829 386 110 343 -333 294 1335 635 97 -1452 -821 -315 -418 -260 -1473 -1237 -1279 31 585 370 1152 592 306 685 524 234 624 -186 -536 -627 463 1107 194 607 -568 81 690 580 441 524 -278 -605 484 -297 -43 -254 372 62 -486 -321 -211 -618 SS 20241205T142942.7Z 9105.603966 108 1 48.80 2 70.61 143.75 107.88 106.17 0.00 1 0.00 1 0 17 4.520e-02 5.619e-03 2.333e-03 2.945e-04 4.327575e-01 1.465128e-04 5.119815e-03 -6.000000e+00 2.540233e-02 223.27 -2.00 3.47 -2.00 318.62 0.00e+00 9.216840e-04 3.121918e-05 1.931341e-04 -6.000000e+00 1.121224e-03 279.28 -2.00 20.00 -2.00 317.98 0.00e+00 2.977 0.000 302.00 328.00 3 2.1012e-01 3.9573e-04 3.6531e-02 -6.0000e+00 6.2566e-02 8.1136e-03 4.5382e-04 2.1720e-02 -6.0000e+00 6.8084e-02 -1.7173e-02 3.2278e-04 1.0904e-02 -6.0000e+00 4.0624e-02 2.9626e-03 1.7212e-04 3.2584e-03 -6.0000e+00 1.7462e-02 1.3317e-02 -4.9968e-04 8.1448e-06 3.5265e-05 -6.0000e+00 1.2021e-03 -7.0711e-04 -1.0771e-04 10 0 0 10 0 0 48.41 20.17 0.30 -0.00071 -0.00446 1228 288 1 5 0 39.570 25.28 20.56 20.17 8.00 5.2 909.62 -15813 -12657 -12693 -14080 -16769 -19467 -17968 -15832 -11604 -11426 -12609 -11449 -9286 -5428 -2962 -1484 -1209 -544 610 -67 647 -454 77 -174 -604 -910 -1220 -1975 -2476 -2175 -264 227 1268 -326 -2583 -2749 -2830 -1513 -330 -97 -490 -334 -222 -123 435 678 141 190 95 59 989 1274 1196 1524 1052 1191 1142 327 461 430 970 1476 1828 1803 1108 326 261 -238 523 847 149 133 -56 -70 -128 -398 -621 -945 -1012 -719 -1141 -1127 -1729 -1810 -1069 -898 -232 -12 57 446 326 768 50 419 576 278 281 454 301 -209 -335 -799 -725 31 -573 -1119 -665 -606 -154 415 329 284 261 405 230 384 328 228 14 -139 -464 -64 174 210 443 521 96 923 643 320 240 -81 -109 42 -33 -167 -218 109 -38 -199 -18 -295 -432 -558 -463 -502 -561 -688 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