File name: Pandora32s1_GreenbeltMD_20240901_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240902T051139.9Z 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 v1.8.59 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20240901_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: 20240901 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 20240901T112934.0Z 9010.478866 98 1 48.64 2 80.66 87.24 63.40 88.74 0.00 1 0.00 1 0 17 5.854e-01 1.801e-02 3.092e-01 9.170e-03 7.142390e-01 5.174664e-03 8.651981e-03 -6.000000e+00 3.451743e-01 230.27 -2.00 3.47 -2.00 321.45 0.00e+00 2.118245e-03 2.748883e-03 6.964466e-03 -6.000000e+00 1.669891e-02 289.68 -2.00 20.00 -2.00 320.85 0.00e+00 5.853 0.003 302.00 328.00 3 3.2071e+00 1.9032e-02 7.8292e-02 -6.0000e+00 8.6237e-01 2.9426e-01 2.6421e-02 6.1789e-02 -6.0000e+00 9.3711e-01 -4.8980e-01 2.5192e-02 2.3682e-02 -6.0000e+00 5.5291e-01 2.1882e-01 1.1807e-02 6.3749e-03 -6.0000e+00 2.3453e-01 3.2062e-05 -7.2406e-04 2.6050e-04 1.0225e-04 -6.0000e+00 1.6568e-02 1.0950e-02 -1.3158e-04 12 9 9 12 12 4 96.81 -62.18 0.80 0.01095 0.00551 14 3 1 5 0 3474.020 26.73 20.00 -62.18 27.22 5.0 1017.86 900000 -129871 -163529 -160288 -116096 -178784 900000 900000 -53404 -66039 -174840 -150056 900000 -87160 900000 804 14949 -49585 -23036 900000 23282 174374 -600 -46033 900000 64085 900000 11324 900000 -34702 125349 -58208 900000 222701 -56530 92726 -30797 16020 -42125 89576 58929 13282 294740 30040 26128 52268 70532 76781 31679 73367 -5981 35184 20899 9231 25302 3142 5805 -4585 14403 16601 9713 12265 5527 6161 -5646 1715 8744 3908 6707 4933 1542 -2437 -46 6849 -6075 1494 -8810 -4063 -2484 -2713 -528 2288 3594 -4542 -746 -2039 205 -170 -1373 -463 992 6290 645 -3310 161 -657 -769 456 -356 167 -1686 -2659 -2065 -2870 -3033 -2659 -824 -412 -270 621 697 43 -287 471 1455 995 460 381 1350 -394 1162 2 2263 302 402 12 -706 254 -445 912 932 -473 -694 -480 -734 -14 -355 1154 -431 1 -514 -425 595 900000 -1746 -3296 -3070 -1309 -3455 900000 900000 -477 -592 -4689 -3433 900000 -1683 900000 10 183 -1245 -483 900000 333 1556 -11 -1382 900000 757 900000 220 900000 -1056 1119 -3096 900000 1988 -3698 1381 -1594 616 -3423 2479 2488 935 2631 1937 1764 2783 3218 3394 2252 3728 -712 3180 2379 1275 3205 513 956 -834 2132 2331 1475 1963 1066 1337 -1478 419 1956 937 1709 1464 527 -911 -17 2241 -2068 428 -2568 -1135 -749 -968 -217 1049 1801 -2613 -440 -1294 135 -116 -947 -310 619 3529 365 -1984 103 -489 -659 439 -380 182 -1792 -2599 -1836 -2539 -2847 -2644 -845 -446 -318 804 997 65 -450 721 2125 1406 650 560 2071 -639 1859 3 3368 445 576 16 -960 350 -681 1545 1719 -935 -1436 -1042 -1688 -33 -868 2819 -1067 3 -1186 -928 1244 SS 20240901T124543.4Z 9010.531752 137 1 21.21 2 65.92 99.57 49.15 101.56 0.00 1 0.00 1 0 17 1.472e-02 5.731e-03 4.197e-03 1.108e-03 3.275328e-01 5.645497e-04 3.860337e-03 -6.000000e+00 8.485456e-03 230.27 -2.00 3.47 -2.00 317.56 0.00e+00 5.713961e-04 8.914666e-05 1.281032e-04 -6.000000e+00 3.813523e-04 289.67 -2.00 20.00 -2.00 316.71 0.00e+00 2.433 0.000 302.00 328.00 3 2.6452e+00 1.5041e-03 2.9492e-02 -6.0000e+00 2.1165e-02 2.3881e-04 1.6950e-03 1.6889e-02 -6.0000e+00 2.2881e-02 -6.4327e-03 1.0353e-03 8.2065e-03 -6.0000e+00 1.3664e-02 1.2997e-04 5.2191e-04 2.2894e-03 -6.0000e+00 5.8398e-03 2.2548e-03 -1.0440e-04 3.1204e-05 2.4835e-05 -6.0000e+00 3.9227e-04 7.5237e-03 -6.4083e-05 12 1 1 12 5 5 99.46 -62.18 0.27 0.00752 0.00674 57 31 1 5 0 365.640 26.94 20.00 -62.18 28.27 5.0 1024.30 -3324 -4041 12 -6282 -3581 -7217 -3810 -1167 -3015 -509 -6186 -1851 -3306 -407 1059 -611 148 140 1573 813 1174 364 329 1595 -173 906 605 -1032 -754 -1432 904 1182 1803 -235 -3112 -1942 -3130 -998 -483 -24 -572 -485 -402 -741 550 98 -147 334 -745 -36 514 1142 592 922 549 646 957 107 741 194 777 1595 1481 1799 679 -183 -138 -618 666 771 204 106 139 88 -153 -280 -673 -1130 -951 -703 -967 -1323 -1750 -1605 -669 -600 -126 222 44 678 490 864 -75 408 720 101 126 555 450 -256 -427 -918 -819 103 -532 -1117 -731 -742 -207 404 277 326 296 353 146 370 267 224 176 58 -346 -97 291 173 409 515 10 960 598 254 211 -204 -218 17 117 -159 -232 159 66 -83 -30 -407 -581 -267 -374 1 -613 -306 -593 -312 -105 -314 -56 -726 -211 -427 -55 166 -110 29 28 330 180 267 83 76 385 -42 230 156 -260 -192 -358 233 311 521 -74 -968 -569 -978 -354 -192 -11 -283 -255 -219 -413 303 55 -81 182 -405 -20 292 655 367 604 376 428 649 74 497 129 522 1135 1158 1438 566 -146 -107 -468 522 646 182 100 132 81 -133 -232 -533 -847 -732 -573 -855 -1313 -1795 -1731 -724 -697 -148 270 55 806 573 922 -77 402 742 111 148 690 607 -336 -556 -1146 -949 119 -668 -1443 -985 -1004 -294 588 415 505 451 526 210 495 367 305 256 87 -535 -148 430 248 580 726 13 1264 841 374 318 -321 -337 27 191 -277 -401 280 117 -146 -52 -680 -943 SS 20240901T125615.7Z 9010.539071 143 1 48.64 2 63.91 101.41 47.21 103.60 0.00 1 0.00 1 0 17 1.076e-02 5.393e-03 1.882e-03 4.971e-04 3.048856e-01 2.528575e-04 3.596567e-03 -6.000000e+00 6.205866e-03 230.27 -2.00 3.47 -2.00 317.60 0.00e+00 4.021471e-04 4.015114e-05 1.239984e-04 -6.000000e+00 2.788542e-04 289.67 -2.00 20.00 -2.00 316.74 0.00e+00 2.260 0.000 302.00 328.00 3 1.9848e+00 6.7441e-04 2.7420e-02 -6.0000e+00 1.5479e-02 -4.8871e-03 7.6043e-04 1.5724e-02 -6.0000e+00 1.6733e-02 1.7479e-03 4.6309e-04 7.6394e-03 -6.0000e+00 9.9923e-03 -4.8535e-03 2.3319e-04 2.1209e-03 -6.0000e+00 4.2717e-03 5.3373e-03 2.2073e-04 1.4103e-05 2.2938e-05 -6.0000e+00 2.8677e-04 7.1740e-03 -3.7444e-06 12 1 1 12 4 4 99.99 -62.18 0.26 0.00717 0.00883 584 137 1 5 0 83.270 27.05 20.01 -62.18 29.00 5.1 1029.22 158 -1828 -1643 -2132 -5079 -3303 -4202 -454 -600 -1072 -2366 -3430 -272 -940 1271 316 -249 528 415 1101 810 304 764 448 778 33 50 -958 -361 -223 460 995 1323 -99 -2913 -2426 -2472 -1636 -45 -352 -688 -647 -772 -823 -13 -27 -670 -266 -615 -461 690 773 796 1000 788 867 878 306 400 315 844 1323 1681 1694 736 -141 -169 -495 475 1008 123 278 21 302 103 -254 -389 -1049 -714 -609 -1071 -1125 -1676 -1746 -849 -597 -150 121 228 504 481 598 -67 505 646 331 238 568 301 -158 -301 -942 -807 20 -430 -1055 -628 -683 -211 392 393 349 266 348 140 268 247 108 112 -106 -303 -59 124 120 450 526 -108 838 486 306 271 -258 -207 -26 37 -13 -131 169 26 -98 -28 -364 -443 12 -165 -156 -198 -436 -281 -371 -43 -60 -116 -262 -388 -33 -134 206 59 -50 109 90 248 189 71 180 103 191 9 13 -244 -86 -55 119 260 379 -30 -888 -700 -752 -572 -17 -162 -356 -332 -411 -446 -7 -15 -361 -140 -320 -241 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