File name: Pandora32s1_GreenbeltMD_20230629_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20230704T172238.6Z 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 v1.8.49 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20230629_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: 20230629 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 20230629T115918.4Z 8580.499519 144 1 48.62 2 66.55 78.36 151.76 312.85 0.00 1 0.00 1 0 25 2.368e-02 5.952e-03 1.329e-02 2.334e-03 3.534032e-01 1.200242e-03 4.118863e-03 -6.000000e+00 1.377971e-02 232.75 -2.00 3.47 -2.00 318.17 0.00e+00 8.196488e-04 2.201522e-04 1.800367e-04 -6.000000e+00 6.110250e-04 288.70 -2.00 20.00 -2.00 317.32 0.00e+00 2.493 0.000 302.00 328.00 3 4.6683e+00 3.2589e-03 3.0987e-02 -6.0000e+00 3.4594e-02 3.5911e-02 3.6915e-03 1.8432e-02 -6.0000e+00 3.7330e-02 -8.9722e-03 2.3778e-03 8.9343e-03 -6.0000e+00 2.2232e-02 -1.3798e-03 1.2289e-03 2.5106e-03 -6.0000e+00 9.4472e-03 2.6343e-04 -3.5920e-04 6.6167e-05 2.5803e-05 -6.0000e+00 6.3129e-04 4.9721e-03 -4.8849e-05 10 0 0 10 0 0 89.35 22.10 0.69 0.00497 0.00227 17 4 1 5 0 2859.630 26.51 20.01 22.10 25.32 3.0 1000.83 4635 -2811 -4278 -5493 -4110 -7414 -4181 -1618 -1839 -8858 -4732 -15042 3639 -5917 3460 -1179 -2817 1656 -58 6469 -793 -2903 3770 -2193 1296 -858 4228 -1570 -882 -2761 1306 1115 1256 -785 -4448 -2649 -2640 -1494 -1338 394 -1520 687 189 142 -801 1050 298 476 -692 -306 389 1080 1015 930 1108 817 546 140 -111 586 598 1085 1655 1102 879 -320 -381 153 -179 1445 109 -196 -354 676 301 -454 -1065 -952 -1732 -1176 -952 -1054 -1473 -1482 -482 -293 -68 160 197 419 469 690 411 -486 711 313 168 934 924 -59 -363 -967 -853 -373 -667 -940 -992 -298 -200 258 326 708 -73 300 261 -182 208 -219 117 -225 -99 117 582 360 287 370 56 626 238 367 131 -440 -567 180 189 9 -142 -171 415 -86 -23 -204 -557 212 -160 -263 -335 -224 -387 -217 -92 -120 -669 -349 -1252 282 -596 375 -153 -403 239 -9 985 -135 -504 617 -403 247 -176 839 -318 -167 -520 250 239 299 -204 -1161 -646 -676 -402 -435 150 -666 314 83 64 -365 473 135 212 -309 -137 183 548 555 541 673 512 353 91 -71 367 380 733 1135 828 686 -241 -266 103 -126 1138 91 -173 -317 580 261 -358 -759 -687 -1203 -915 -846 -980 -1494 -1485 -508 -331 -81 187 232 481 536 721 421 -481 727 335 202 1172 1262 -78 -482 -1180 -1021 -446 -808 -1222 -1352 -399 -283 391 501 1125 -115 446 378 -247 292 -302 171 -353 -151 176 896 536 408 530 77 838 341 542 207 -690 -912 298 332 17 -260 -319 779 -159 -41 -347 -967 SS 20230629T121326.4Z 8580.509333 149 1 48.01 2 63.85 80.35 153.63 318.56 0.00 1 0.00 1 0 25 1.547e-02 5.780e-03 6.441e-03 1.627e-03 3.207636e-01 8.354272e-04 3.766857e-03 -6.000000e+00 9.008346e-03 232.75 -2.00 3.47 -2.00 317.62 0.00e+00 6.683721e-04 1.325077e-04 1.666640e-04 -6.000000e+00 3.993863e-04 288.70 -2.00 20.00 -2.00 316.79 0.00e+00 2.255 0.000 302.00 328.00 3 4.2927e+00 2.2364e-03 2.8066e-02 -6.0000e+00 2.2616e-02 2.9518e-02 2.5149e-03 1.6717e-02 -6.0000e+00 2.4403e-02 -6.5041e-03 1.5414e-03 8.0937e-03 -6.0000e+00 1.4533e-02 -1.2761e-03 7.7620e-04 2.2456e-03 -6.0000e+00 6.1768e-03 5.0728e-04 -2.0258e-04 4.5797e-05 2.3179e-05 -6.0000e+00 4.1257e-04 4.2932e-03 -2.5363e-05 10 0 0 10 0 0 88.50 22.15 0.47 0.00429 0.00277 28 7 1 5 0 1714.550 26.51 20.01 22.15 25.63 3.0 1002.86 -6176 -1242 956 -3291 -7712 -5595 1225 -3509 2291 -1726 -3275 -7724 -831 -613 -833 1745 -1913 1159 -11 1756 626 -1284 1772 -297 1733 -146 373 678 -1443 -303 -17 417 1124 -982 -2039 -2777 -2497 -1467 -395 400 -3 -453 -965 56 67 475 -24 367 -175 -1167 29 1015 1082 1043 492 608 570 -394 315 -6 1212 1070 2051 1779 665 254 -449 -650 41 1360 192 386 91 141 265 -458 -813 -1136 -1177 -453 -1395 -1181 -1643 -1698 -796 -757 113 414 429 815 535 225 -286 267 37 309 226 491 544 -264 -141 -1011 -1054 -385 -750 -881 -583 -458 -181 513 561 427 425 430 244 137 -129 85 -83 -41 -209 166 419 312 295 229 -172 534 301 295 92 -117 -304 68 65 75 86 -130 291 7 -92 -361 -714 -488 -107 85 -299 -661 -433 91 -306 214 -181 -354 -881 -98 -85 -135 313 -382 235 -2 357 133 -278 374 -67 413 -37 96 167 -341 -69 -4 109 321 -305 -619 -805 -758 -509 -151 181 -2 -229 -510 30 36 253 -13 191 -91 -611 16 589 674 688 341 403 387 -272 212 -4 808 760 1580 1398 546 212 -348 -485 32 1100 175 373 84 134 236 -397 -634 -833 -882 -378 -1255 -1114 -1689 -1838 -856 -874 137 495 518 956 622 254 -297 263 38 350 271 620 744 -350 -186 -1231 -1258 -458 -913 -1149 -793 -620 -258 739 862 680 665 634 349 191 -177 114 -120 -60 -317 249 640 460 414 324 -231 701 420 425 142 -178 -474 109 106 129 146 -227 510 12 -160 -603 -1158 SS 20230629T121910.4Z 8580.513314 152 1 48.14 2 62.75 81.16 154.33 321.06 0.00 1 0.00 1 0 25 1.253e-02 5.564e-03 4.559e-03 1.299e-03 3.087504e-01 6.665407e-04 3.622365e-03 -6.000000e+00 7.292173e-03 232.75 -2.00 3.47 -2.00 317.35 0.00e+00 4.021565e-04 9.839522e-05 1.203552e-04 -6.000000e+00 3.233194e-04 288.70 -2.00 20.00 -2.00 316.51 0.00e+00 2.172 0.000 302.00 328.00 3 3.9952e+00 1.7794e-03 2.7003e-02 -6.0000e+00 1.8307e-02 2.1927e-02 1.9973e-03 1.6051e-02 -6.0000e+00 1.9754e-02 -2.9596e-03 1.2044e-03 7.7609e-03 -6.0000e+00 1.1765e-02 -2.9153e-03 5.9883e-04 2.1273e-03 -6.0000e+00 4.9999e-03 7.5689e-04 -1.8635e-04 3.6516e-05 2.2717e-05 -6.0000e+00 3.3401e-04 4.2261e-03 -4.3117e-05 11 1 0 11 8 0 77.06 22.17 0.50 0.00423 0.00283 39 9 1 5 0 1234.340 26.62 20.00 22.17 26.05 3.1 1005.85 -1803 338 -2280 -4719 -6240 -5673 -16 -470 -789 -1807 -2102 -3746 -668 -1416 350 1007 -1 1199 744 1782 1207 20 2056 325 1554 1020 961 -553 -628 -1150 -41 992 1221 -407 -2624 -2287 -2895 -1989 -869 100 -754 -247 -791 -336 -519 -20 -255 -316 -237 -760 -57 887 541 1431 906 1018 391 57 190 124 1159 1336 1684 1519 943 -121 -388 -419 300 1256 366 188 123 223 269 -518 -587 -1325 -1132 -877 -1184 -1018 -1595 -1595 -815 -609 -126 261 399 815 431 437 -318 297 347 449 245 474 361 -102 -187 -805 -766 -292 -631 -870 -747 -364 -106 385 380 325 198 367 136 19 4 58 -8 70 -253 57 406 336 300 347 -39 549 286 422 250 -88 -284 66 85 -143 29 94 166 14 -68 -382 -710 -158 33 -242 -501 -605 -505 -1 -46 -88 -219 -258 -471 -90 -224 63 205 0 250 164 405 285 5 484 82 414 288 275 -154 -164 -292 -11 284 383 -138 -877 -722 -966 -759 -366 50 -393 -136 -455 -196 -303 -12 -148 -180 -132 -428 -33 556 340 943 626 721 286 42 137 88 829 1016 1308 1280 824 -101 -300 -310 230 1078 333 182 120 211 240 -446 -454 -1030 -897 -727 -1055 -1010 -1629 -1713 -922 -700 -153 312 482 1006 501 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