File name: Pandora32s1_GreenbeltMD_20250328_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20250329T051821.0Z 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 v1.8.75 Instrument operation file used: Pandora32_OF_v2d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20250328_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: 20250328 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 20250328T125511.1Z 9218.538323 88 1 49.18 2 68.17 104.28 64.16 117.31 0.00 1 0.00 1 0 17 8.948e-02 6.135e-03 3.561e-02 3.462e-03 3.981726e-01 1.747086e-03 4.604458e-03 -6.000000e+00 5.109613e-02 227.35 -2.00 3.47 -2.00 318.97 0.00e+00 1.528111e-03 4.035630e-04 2.974962e-04 -6.000000e+00 2.219724e-03 279.35 -2.00 20.00 -2.00 318.33 0.00e+00 2.665 0.000 302.00 328.00 3 4.9584e+00 4.7951e-03 3.3332e-02 -6.0000e+00 1.2702e-01 4.8484e-02 5.5232e-03 2.0246e-02 -6.0000e+00 1.3779e-01 -1.9270e-02 4.0227e-03 1.0217e-02 -6.0000e+00 8.1972e-02 1.3676e-03 2.1273e-03 3.4549e-03 -6.0000e+00 3.4951e-02 1.5685e-04 1.0377e-03 9.8417e-05 3.4387e-05 -6.0000e+00 2.3813e-03 1.6020e-03 1.6144e-04 10 0 0 10 0 0 100.00 20.69 0.43 0.00160 0.00940 35 8 1 5 0 1405.040 25.68 20.16 20.69 14.45 5.5 949.71 84032 -16355 -19805 -16299 -7045 -31584 2117 -7749 2068 -15584 -7078 -30181 10626 -7033 -5347 5055 -8580 3330 -2068 4759 -1610 -3994 4482 -3477 4435 227 5887 -1325 -3287 -1277 1765 1453 2024 -2606 -647 -2995 -3936 -4475 -1483 86 -518 1489 -537 2066 162 1067 1964 1413 30 -2157 -258 2417 2325 1999 -397 500 260 118 -120 13 1416 -526 1782 2057 1054 -78 -167 507 -158 1044 320 -610 112 108 -824 -969 -614 -762 -1780 -289 -1826 -597 -1808 -1424 -70 -661 367 -196 582 586 -47 833 -590 -181 1000 116 126 522 674 -594 547 -903 -506 136 -601 -1057 -650 -127 156 460 35 137 285 -43 473 355 -86 66 322 49 -447 200 383 370 316 -299 -185 242 433 386 -139 39 -582 -57 -11 119 -191 -137 141 -255 142 228 -346 1127 -637 -852 -672 -245 -1285 65 -289 80 -765 -328 -1779 486 -450 -399 393 -827 305 -212 477 -178 -451 473 -417 529 30 745 -174 -419 -158 228 211 326 -470 -112 -506 -703 -920 -354 24 -161 486 -186 714 57 377 692 497 11 -798 -99 981 1013 925 -196 252 135 62 -62 7 717 -287 1040 1297 696 -51 -102 301 -99 717 243 -489 90 84 -614 -666 -386 -459 -1115 -200 -1435 -511 -1677 -1374 -70 -703 406 -225 666 660 -50 835 -558 -166 951 122 145 653 901 -812 711 -1108 -581 156 -728 -1354 -860 -173 223 694 56 226 467 -67 706 506 -122 95 486 78 -723 320 597 561 465 -427 -255 331 623 595 -226 66 -1001 -100 -21 228 -374 -271 281 -503 271 420 -624 SS 20250328T135459.3Z 9218.579853 134 1 48.24 2 57.24 115.76 54.49 130.04 0.00 1 0.00 1 0 17 2.037e-02 6.818e-03 1.247e-02 3.468e-03 2.824372e-01 1.749353e-03 3.320505e-03 -6.000000e+00 1.163898e-02 227.36 -2.00 3.47 -2.00 317.61 0.00e+00 5.127475e-04 2.703225e-04 7.249982e-05 -6.000000e+00 5.065868e-04 279.35 -2.00 20.00 -2.00 316.95 0.00e+00 1.842 0.000 302.00 328.00 3 5.8908e+00 4.6345e-03 2.3243e-02 -6.0000e+00 2.8935e-02 4.1280e-02 5.2203e-03 1.4271e-02 -6.0000e+00 3.1402e-02 -1.3792e-03 3.2326e-03 7.0515e-03 -6.0000e+00 1.8666e-02 -4.0110e-03 1.6338e-03 2.0801e-03 -6.0000e+00 8.0126e-03 1.6275e-04 1.0037e-03 9.9435e-05 2.1880e-05 -6.0000e+00 5.4666e-04 -1.1663e-03 1.6361e-04 11 8 0 10 0 0 99.99 21.10 0.45 -0.00117 0.00638 30 7 1 5 0 1607.920 26.00 20.06 21.10 17.02 5.5 965.01 900000 -711 -5654 -3458 -4043 -4101 9278 4851 6926 -4956 -5962 -8431 -340 -42 -666 1527 -2735 2277 2900 4412 1731 -812 3300 -636 2458 -1025 3434 3456 -524 -1657 897 -1768 1749 -1358 -3301 -2700 -2605 -1680 -1244 -28 -1364 -920 -2193 69 402 152 297 250 -541 -1727 141 1830 553 1431 356 986 36 -580 236 752 2192 719 1804 839 -36 -616 -552 359 251 1606 39 442 454 225 -1 -483 -567 -1297 -1838 -666 -1601 -1295 -1699 -1456 -493 -826 624 200 520 451 551 1684 -692 -173 1003 782 80 681 1083 -430 -425 -679 -879 -250 -371 -613 -1205 -474 64 443 182 166 327 -50 303 -150 170 124 -70 284 -549 75 601 -134 486 149 61 -235 191 194 49 637 -281 -249 -346 -3 86 -5 583 -310 352 -391 -501 900000 -69 -606 -354 -378 -354 720 433 684 -587 -719 -1042 -42 -6 -110 275 -545 449 594 923 383 -184 720 -150 598 -270 880 854 -126 -389 213 -465 485 -408 -979 -756 -758 -550 -479 -13 -677 -480 -1191 37 217 82 160 132 -283 -909 75 1031 333 897 233 655 25 -399 159 498 1456 509 1359 679 -30 -495 -413 256 185 1289 35 409 425 206 -1 -394 -422 -916 -1319 -518 -1390 -1222 -1713 -1521 -535 -951 744 247 645 551 640 1813 -704 -168 994 835 94 856 1442 -584 -555 -832 -1020 -291 -456 -794 -1621 -656 91 661 285 265 514 -75 431 -202 224 169 -100 425 -845 115 899 -195 684 203 80 -305 257 277 73 969 -436 -396 -573 -5 151 -10 1043 -553 609 -660 -829 SS 20250328T141700.8Z 9218.595148 144 1 4.86 2 53.47 120.62 51.33 135.49 0.00 1 0.00 1 0 17 9.138e-03 5.704e-03 3.279e-03 1.627e-03 2.557867e-01 8.256103e-04 3.058530e-03 -6.000000e+00 5.215200e-03 227.36 -2.00 3.47 -2.00 316.13 0.00e+00 4.758076e-04 8.867798e-05 3.905136e-05 -6.000000e+00 2.267338e-04 279.36 -2.00 20.00 -2.00 315.51 0.00e+00 1.676 0.000 302.00 328.00 3 2.7625e+00 2.1385e-03 2.1098e-02 -6.0000e+00 1.2964e-02 1.8017e-02 2.3876e-03 1.2903e-02 -6.0000e+00 1.4066e-02 -1.0630e-02 1.3820e-03 6.3558e-03 -6.0000e+00 8.3674e-03 8.8157e-04 6.4465e-04 1.8224e-03 -6.0000e+00 3.5663e-03 4.6080e-03 -2.1616e-05 4.5350e-05 2.1516e-05 -6.0000e+00 2.4322e-04 4.3316e-04 -2.5467e-05 12 1 1 12 1 1 99.37 21.32 0.29 0.00043 0.00027 15 39 1 5 0 291.170 26.21 20.01 21.32 18.53 5.6 974.00 457 -1065 -1952 -2046 -4144 -3023 -1544 -297 -36 -1272 -2013 -2842 205 263 66 208 179 45 700 1319 1647 1181 1166 700 541 42 -101 123 -567 307 -25 1474 1279 450 -1879 -1631 -2355 -802 362 287 -598 -729 -564 -593 -51 -220 -486 -488 -338 -437 237 1001 880 1475 451 1035 584 339 526 588 971 1137 1018 1093 489 -243 -36 -315 247 934 -138 185 -134 -29 -31 -120 -256 -689 -684 -744 -1224 -1273 -1858 -1795 -835 -785 -287 -90 244 523 419 715 98 566 600 161 405 526 398 -455 -237 -848 -242 89 -445 -660 -789 -456 -204 337 120 256 -87 243 82 443 560 244 419 4 -339 -51 246 447 567 211 105 826 538 363 28 -179 -62 154 255 -136 -171 76 -8 -307 -109 -546 -477 84 -224 -433 -440 -812 -535 -273 -58 -8 -302 -484 -683 48 70 21 67 61 16 253 491 629 451 445 280 215 18 -43 50 -229 118 -10 622 548 205 -842 -688 -1042 -401 202 178 -395 -510 -386 -411 -35 -152 -350 -343 -231 -296 165 703 659 1156 352 820 474 277 421 463 773 958 891 1028 453 -224 -32 -264 213 854 -135 184 -135 -29 -30 -110 -221 -582 -554 -669 -1192 -1315 -1992 -1934 -945 -916 -341 -111 303 632 494 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