File name: Pandora32s1_GreenbeltMD_20240828_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240829T051456.9Z 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_20240828_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: 20240828 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 20240828T114126.5Z 9006.487112 234 1 48.17 2 77.70 87.75 17.14 123.05 0.00 1 0.00 1 0 17 5.575e-01 1.824e-02 2.378e-01 8.758e-03 5.753617e-01 4.786408e-03 6.502999e-03 -6.000000e+00 3.277362e-01 230.58 -2.00 3.47 -2.00 320.90 0.00e+00 -2.492220e-03 2.135396e-03 1.562053e-03 -6.000000e+00 1.595920e-02 289.96 -2.00 20.00 -2.00 320.21 0.00e+00 4.557 0.002 302.00 328.00 3 4.4105e+00 1.6014e-02 5.5126e-02 -6.0000e+00 8.1746e-01 1.0188e-02 2.1070e-02 3.3311e-02 -6.0000e+00 8.8592e-01 -1.2607e-01 1.9180e-02 1.5237e-02 -6.0000e+00 5.2393e-01 6.1140e-02 9.3430e-03 5.5753e-03 -6.0000e+00 2.2540e-01 3.9852e-05 -3.1964e-04 2.5786e-04 5.0893e-05 -6.0000e+00 1.5609e-02 1.2907e-02 -5.8811e-05 12 9 9 12 4 4 99.91 -62.18 0.60 0.01291 0.01051 22 5 1 5 0 2189.410 27.15 20.01 -62.18 30.18 5.0 1034.50 900000 -148349 900000 900000 -131776 -117695 900000 900000 -121125 -88305 6115 -116185 900000 -114140 -13667 41219 -16754 36569 91949 274403 -11827 15504 12193 2851 12977 20607 900000 8602 436289 -44163 27182 25161 53623 -11740 -21223 32225 -43030 -10449 -30714 24189 19166 -456 23426 35624 15676 2370 19614 50309 -7876 28633 -2139 33396 12940 -3566 14909 -14514 7877 4609 5648 8638 -406 6670 1341 8581 -3798 -5820 2719 1851 -557 931 2157 -3753 -1722 -1117 -1794 -759 -6514 1705 -5057 -1510 2298 -1765 1681 -2393 2918 -1822 -4321 -848 193 3728 689 7262 -2281 -2293 157 -462 -70 2284 -724 -168 -983 -2152 -208 -1056 -540 -1232 -686 -501 1034 -1063 1204 843 1080 -470 1010 512 -345 138 629 260 -462 -1155 1426 736 45 -309 -1279 917 -16 977 507 -1817 -756 874 -310 524 224 -1741 549 565 841 -113 -708 900000 -3104 900000 900000 -2337 -1748 900000 900000 -2680 -1589 52 -3059 900000 -4226 -239 504 -396 568 912 2341 -344 352 296 83 380 605 900000 282 3721 -2289 809 889 1667 -729 -1416 1271 -3643 -767 -3330 1898 1794 -55 2384 3307 1764 304 2171 4249 -1178 3194 -346 4328 2222 -774 2905 -3902 1792 1090 1300 1885 -98 1613 381 2535 -1336 -2053 855 593 -197 371 948 -1838 -836 -519 -782 -298 -2481 592 -2000 -669 1138 -1027 1041 -1629 2015 -1400 -3587 -706 160 2929 526 4902 -1592 -1603 117 -389 -66 2386 -847 -198 -1123 -2278 -200 -1024 -555 -1352 -784 -602 1313 -1500 1813 1341 1729 -741 1496 729 -492 203 969 421 -761 -1870 2195 1109 66 -441 -1775 1265 -25 1617 909 -3482 -1489 1777 -672 1181 518 -4144 1291 1300 1851 -240 -1462 SS 20240828T125207.7Z 9006.536200 271 1 48.59 2 64.02 99.23 10.57 184.43 0.00 1 0.00 1 0 17 1.004e-02 5.546e-03 1.081e-03 3.334e-04 3.038641e-01 1.699990e-04 3.597173e-03 -6.000000e+00 5.792708e-03 230.58 -2.00 3.47 -2.00 317.31 0.00e+00 4.457197e-04 2.488928e-05 1.037867e-04 -6.000000e+00 2.603906e-04 289.96 -2.00 20.00 -2.00 316.45 0.00e+00 2.269 0.000 302.00 328.00 3 1.3104e+00 4.5085e-04 2.7476e-02 -6.0000e+00 1.4458e-02 -2.4428e-02 5.0624e-04 1.5682e-02 -6.0000e+00 1.5628e-02 -5.7897e-03 3.0317e-04 7.6140e-03 -6.0000e+00 9.3314e-03 -2.2471e-04 1.5023e-04 2.1089e-03 -6.0000e+00 3.9855e-03 1.0538e-02 -2.6594e-04 9.4158e-06 2.2872e-05 -6.0000e+00 2.6761e-04 9.2193e-03 -7.6101e-05 12 1 1 12 4 4 27.97 -62.18 0.29 0.00922 0.00722 648 152 1 5 0 74.970 27.35 20.01 -62.18 30.97 5.1 1040.32 -377 -843 -694 -2587 -4434 -3903 -2613 -427 -152 -1309 -2859 -2402 -1181 -446 489 524 -171 379 706 861 1235 81 1085 703 696 282 -39 -613 -614 -611 585 1034 1794 -118 -2682 -2328 -2410 -1090 -68 -144 -730 -570 -556 -647 -22 -119 -505 -379 -652 -519 538 787 622 1036 524 752 865 178 361 241 770 1283 1569 1762 743 -83 -71 -499 607 1048 276 259 21 256 114 -284 -516 -1019 -782 -581 -1112 -1141 -1750 -1728 -743 -626 -63 168 342 582 452 713 -41 428 597 259 261 446 265 -245 -434 -870 -770 27 -497 -1097 -713 -699 -240 302 310 334 299 373 148 303 296 149 53 -13 -361 -72 143 170 533 523 -21 880 617 320 272 -170 -190 22 81 -72 -165 184 43 -168 -49 -387 -535 -36 -93 -81 -297 -466 -378 -257 -46 -19 -175 -391 -330 -178 -71 90 109 -38 88 172 218 323 21 286 181 192 82 -11 -175 -163 -171 156 303 575 -41 -915 -753 -822 -426 -30 -69 -396 -307 -311 -368 -13 -67 -286 -211 -381 -304 307 484 410 678 359 528 622 129 258 169 549 972 1225 1487 617 -69 -55 -393 467 910 254 241 19 246 103 -246 -402 -792 -622 -489 -1015 -1104 -1843 -1823 -826 -713 -76 201 412 682 519 783 -43 431 628 287 309 563 348 -325 -571 -1052 -905 32 -608 -1446 -940 -965 -333 447 470 503 459 538 205 407 391 204 75 -19 -542 -107 215 246 764 715 -29 1172 839 456 412 -258 -294 35 132 -121 -285 312 74 -295 -83 -652 -876 SS 20240828T125743.6Z 9006.540088 274 1 48.58 2 62.95 100.20 10.71 190.89 0.00 1 0.00 1 0 17 9.758e-03 5.622e-03 9.044e-04 3.050e-04 2.935131e-01 1.554566e-04 3.479090e-03 -6.000000e+00 5.631263e-03 230.58 -2.00 3.47 -2.00 317.13 0.00e+00 4.695806e-04 2.173766e-05 8.889370e-05 -6.000000e+00 2.531288e-04 289.96 -2.00 20.00 -2.00 316.27 0.00e+00 2.187 0.000 302.00 328.00 3 1.2324e+00 4.1126e-04 2.6496e-02 -6.0000e+00 1.4055e-02 -2.3072e-02 4.6162e-04 1.5147e-02 -6.0000e+00 1.5192e-02 -5.5479e-03 2.7383e-04 7.3600e-03 -6.0000e+00 9.0712e-03 -1.1306e-04 1.3429e-04 2.0423e-03 -6.0000e+00 3.8745e-03 1.2511e-02 -2.5221e-04 8.6047e-06 2.2348e-05 -6.0000e+00 2.6014e-04 9.0029e-03 -7.3901e-05 12 1 1 12 4 4 38.33 -62.18 0.30 0.00900 0.00711 728 171 1 5 0 66.720 27.45 20.01 -62.18 31.51 5.1 1043.64 -461 16 -442 -2401 -4187 -3638 -2634 -634 662 -1141 -2713 -2326 -1044 173 318 542 -318 692 787 1008 1302 149 998 838 634 310 -42 -844 -783 -360 660 849 1729 -167 -2541 -2325 -2212 -1181 -91 -111 -830 -442 -621 -546 -177 -78 -490 -513 -651 -586 586 759 670 991 542 771 939 306 321 228 823 1243 1599 1692 734 -141 -70 -439 665 1027 213 267 52 182 41 -280 -485 -1004 -801 -609 -1147 -1122 -1774 -1718 -807 -624 -16 92 276 591 459 670 -29 429 616 221 251 493 275 -204 -362 -989 -767 57 -537 -1087 -683 -736 -253 309 341 324 318 362 126 285 255 145 65 -45 -374 -37 175 191 500 520 52 918 603 338 307 -185 -204 74 61 -72 -159 160 10 -166 -6 -465 -540 -50 2 -58 -310 -493 -394 -291 -77 90 -170 -413 -355 -159 30 65 124 -78 176 193 257 342 39 264 234 190 98 -13 -261 -226 -100 190 268 593 -62 -924 -802 -803 -456 -42 -57 -449 -252 -368 -329 -106 -47 -294 -301 -377 -339 350 489 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