File name: Pandora32s1_GreenbeltMD_20240826_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240827T051814.7Z 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 v1.8.59 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20240826_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: 20240826 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 20240826T114143.9Z 9004.487314 239 1 48.00 2 77.33 87.13 17.02 219.49 0.00 1 0.00 1 0 17 3.309e-01 1.299e-02 1.530e-01 6.433e-03 5.881002e-01 3.428441e-03 6.783904e-03 -6.000000e+00 1.922147e-01 230.73 -2.00 3.47 -2.00 320.77 0.00e+00 1.433644e-03 1.443985e-03 2.098759e-03 -6.000000e+00 8.630154e-03 290.10 -2.00 20.00 -2.00 320.06 0.00e+00 4.432 0.001 302.00 328.00 3 4.0126e+00 1.1135e-02 5.4456e-02 -6.0000e+00 4.7977e-01 8.5576e-02 1.4433e-02 3.3478e-02 -6.0000e+00 5.1875e-01 -1.5970e-01 1.2798e-02 1.6295e-02 -6.0000e+00 3.0884e-01 6.4336e-02 6.2938e-03 4.3996e-03 -6.0000e+00 1.3133e-01 6.2770e-05 -6.1565e-04 1.8156e-04 5.7990e-05 -6.0000e+00 8.8803e-03 1.2820e-02 -1.2357e-04 12 9 9 12 4 4 99.99 -62.18 0.71 0.01282 0.00819 26 6 1 5 0 1845.690 26.62 20.00 -62.18 26.47 5.0 1014.77 -102692 -99124 -101524 -103333 -50041 -146324 900000 -88590 -114544 -113186 -122453 -108700 -37231 -23009 -13712 -16039 -21469 -2567 26151 81301 -10254 -23429 25513 -14407 -49428 16116 15332 -22560 -8369 -35267 38429 -2780 5883 -17857 -19859 18220 -19958 627 -11610 19620 -4369 4123 6511 10917 17129 8439 16169 15166 -2774 11019 -9163 18798 4839 5123 2484 -1231 8926 -2610 5641 7616 3104 3483 5952 3310 -2924 -447 877 3738 1295 2705 -877 -936 1132 141 -1940 93 -5674 -226 -1319 -657 -602 666 -1197 -4801 1012 -54 -863 1006 -82 1646 12 3904 -1367 -254 -1063 -786 -1248 561 574 -1506 -544 -1625 -2010 -451 -1538 -1362 -312 -668 392 456 828 -489 427 915 457 819 -180 -15 365 487 443 -202 799 121 735 -742 -417 781 -134 1370 74 -678 107 -131 -142 256 -158 -1113 534 415 207 66 -908 -1304 -1451 -1653 -1703 -454 -3177 900000 -1323 -2508 -2666 -3280 -2750 -569 -385 -259 -370 -586 -64 537 1041 -326 -846 593 -529 -2741 513 503 -1033 -325 -1810 1116 -140 315 -1300 -1447 899 -1496 45 -1141 1722 -543 511 829 1372 2055 1112 2020 1947 -435 1591 -1741 3063 983 1119 592 -316 2157 -706 1387 1799 777 937 1752 1115 -1106 -163 306 1277 489 1146 -426 -479 571 69 -902 39 -2287 -85 -541 -310 -328 406 -811 -3552 753 -44 -731 868 -72 1385 10 2864 -997 -184 -839 -698 -1258 622 693 -1885 -646 -1789 -2056 -453 -1653 -1548 -367 -829 516 654 1285 -805 703 1459 698 1197 -264 -23 579 805 738 -331 1262 187 1097 -1085 -588 1107 -207 2307 135 -1306 212 -272 -310 580 -367 -2638 1259 960 462 141 -1889 SS 20240826T121153.8Z 9004.508262 252 1 48.63 2 71.47 91.88 21.21 235.41 0.00 1 0.00 1 0 17 5.943e-02 5.993e-03 2.781e-02 2.324e-03 4.268190e-01 1.192301e-03 4.934943e-03 -6.000000e+00 3.432334e-02 230.73 -2.00 3.47 -2.00 319.31 0.00e+00 7.324585e-04 3.153292e-04 4.459917e-04 -6.000000e+00 1.542799e-03 290.10 -2.00 20.00 -2.00 318.48 0.00e+00 3.106 0.000 302.00 328.00 3 3.8709e+00 3.3789e-03 3.8027e-02 -6.0000e+00 8.5695e-02 -1.2765e-02 3.9672e-03 2.2246e-02 -6.0000e+00 9.2607e-02 -6.2777e-03 2.9555e-03 1.0904e-02 -6.0000e+00 5.5295e-02 -3.0353e-03 1.5542e-03 3.0731e-03 -6.0000e+00 2.3617e-02 3.0624e-04 8.5593e-05 6.6209e-05 3.2468e-05 -6.0000e+00 1.5843e-03 9.2457e-03 -1.3913e-05 12 1 1 12 4 4 99.99 -62.18 0.39 0.00925 0.00989 56 13 1 5 0 868.210 26.83 20.01 -62.18 27.31 5.0 1018.98 -20109 -16085 -16961 -23269 -28479 -27151 19276 -15713 6479 -5483 -13020 -15573 -15775 -3954 -2054 2420 -5889 -4257 4824 4291 -439 -2625 2542 -7728 -3506 -2117 2564 430 -947 -2278 547 -1763 3557 -4812 -3307 -4807 -5788 -1184 -3356 587 -903 1020 -1569 948 1451 321 600 785 -2 -601 98 2458 497 1689 1109 279 1267 -732 770 4 1676 1098 1979 2811 227 143 248 127 286 1474 327 -218 155 18 8 -231 -1063 -905 -1659 -524 -1139 -754 -1704 -2324 -507 -458 -228 117 696 1121 277 1078 -32 310 262 79 294 615 229 -10 -302 -1271 -1280 -183 -785 -887 -804 -670 -28 306 524 319 547 124 339 94 -95 116 150 217 -472 8 357 201 529 133 -367 699 118 392 271 -199 -238 170 -7 -276 -86 -13 206 -12 177 -260 -503 -472 -422 -482 -694 -820 -730 353 -448 171 -176 -460 -589 -682 -184 -112 145 -419 -318 355 332 -37 -227 213 -760 -358 -227 268 45 -95 -231 58 -218 470 -736 -489 -694 -891 -202 -701 140 -244 289 -475 287 441 100 186 243 -1 -195 34 896 198 710 490 128 593 -351 359 2 778 545 1065 1632 140 86 141 71 168 959 235 -165 118 14 6 -150 -639 -526 -1006 -353 -863 -628 -1529 -2191 -496 -471 -245 129 770 1215 288 1050 -30 281 250 82 335 761 303 -14 -391 -1547 -1470 -210 -950 -1129 -1060 -915 -40 460 830 522 890 196 509 135 -135 170 230 346 -769 13 562 308 787 193 -516 977 174 621 451 -342 -419 308 -12 -540 -172 -26 419 -24 346 -493 -933 SS 20240826T121744.0Z 9004.512314 255 1 48.71 2 70.34 92.81 22.13 237.86 0.00 1 0.00 1 0 17 3.479e-02 5.659e-03 6.133e-03 7.818e-04 4.038704e-01 3.990556e-04 4.708682e-03 -6.000000e+00 2.008699e-02 230.73 -2.00 3.47 -2.00 318.66 0.00e+00 8.200176e-04 8.607639e-05 2.734164e-04 -6.000000e+00 9.029973e-04 290.10 -2.00 20.00 -2.00 317.80 0.00e+00 2.938 0.000 302.00 328.00 3 2.1454e+00 1.0974e-03 3.5951e-02 -6.0000e+00 5.0151e-02 -1.9338e-02 1.2614e-03 2.0961e-02 -6.0000e+00 5.4203e-02 -1.4887e-02 8.6570e-04 1.0226e-02 -6.0000e+00 3.2363e-02 1.9379e-03 4.5459e-04 2.8866e-03 -6.0000e+00 1.3819e-02 2.0914e-03 -2.1158e-04 2.2006e-05 3.0331e-05 -6.0000e+00 9.2756e-04 9.3807e-03 -9.1450e-05 12 1 1 12 4 4 98.14 -62.18 0.31 0.00938 0.00779 208 49 1 5 0 234.150 26.83 20.00 -62.18 27.41 5.0 1019.74 -5671 -12270 -10094 -8169 -18373 -11714 -15770 -10384 -5406 -7982 -7443 -11743 -4876 -6513 -1151 -58 -1937 1400 626 895 -345 -344 1540 -499 1088 -360 629 -2472 -2642 -1711 -325 1059 720 -136 -3609 -3218 -2133 -1790 76 -182 -809 -479 -807 -66 167 454 -346 100 -451 -552 1025 936 1113 1209 839 1159 829 553 108 346 627 1232 2013 2173 1124 -106 167 -479 351 1051 157 384 86 244 21 -520 -813 -1352 -1115 -908 -1323 -1089 -1767 -1720 -854 -515 -51 209 370 667 653 656 25 263 431 263 111 633 388 -239 -337 -1063 -940 -113 -555 -1212 -654 -719 -196 448 299 428 351 316 193 200 323 9 17 -7 -315 70 219 254 452 471 -99 767 543 318 383 -284 -317 -126 -7 27 -210 212 97 -114 49 -407 -483 -198 -483 -416 -325 -735 -452 -660 -425 -241 -396 -376 -642 -285 -466 -94 -5 -201 150 72 108 -44 -44 195 -69 160 -57 100 -392 -398 -253 -51 171 131 -27 -717 -610 -424 -414 21 -56 -282 -178 -314 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