File name: Pandora2s1_GreenbeltMD_20250210_L2Fit_fout2c13d20240823p1-8.txt File generation date: 20250301T104640.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 2 Spectrometer number: 1 Processing software version used: BlickP v1.8.74 Instrument operation file used: Pandora2_OF_v2d20210816.txt Instrument calibration file used: Pandora2s1_CF_v13d20240823.txt Level 1 file used: Pandora2s1_GreenbeltMD_20250210_L1_smca1c13d20240823p1-8.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: 20250210 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: New VP starting 20240823 after field enclosure replaced First and last pixel inside fitting window: 198 339 Nominal wavelengths inside fitting window [nm]: 305.1348 305.2759 305.4170 305.5580 305.6991 305.8401 305.9811 306.1221 306.2631 306.4041 306.5451 306.6860 306.8270 306.9679 307.1088 307.2497 307.3907 307.5315 307.6724 307.8133 307.9542 308.0950 308.2358 308.3767 308.5175 308.6583 308.7991 308.9399 309.0806 309.2214 309.3622 309.5029 309.6436 309.7843 309.9250 310.0657 310.2064 310.3471 310.4877 310.6284 310.7690 310.9097 311.0503 311.1909 311.3315 311.4720 311.6126 311.7532 311.8937 312.0343 312.1748 312.3153 312.4558 312.5963 312.7368 312.8772 313.0177 313.1582 313.2986 313.4390 313.5794 313.7198 313.8602 314.0006 314.1410 314.2813 314.4217 314.5620 314.7023 314.8426 314.9829 315.1232 315.2635 315.4038 315.5440 315.6843 315.8245 315.9647 316.1049 316.2451 316.3853 316.5255 316.6657 316.8058 316.9460 317.0861 317.2262 317.3663 317.5064 317.6465 317.7866 317.9267 318.0667 318.2067 318.3468 318.4868 318.6268 318.7668 318.9068 319.0467 319.1867 319.3267 319.4666 319.6065 319.7464 319.8863 320.0262 320.1661 320.3060 320.4458 320.5857 320.7255 320.8654 321.0052 321.1450 321.2848 321.4245 321.5643 321.7041 321.8438 321.9835 322.1233 322.2630 322.4027 322.5423 322.6820 322.8217 322.9613 323.1010 323.2406 323.3802 323.5198 323.6594 323.7990 323.9386 324.0781 324.2177 324.3572 324.4968 324.6363 324.7758 324.9153 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20250210T131005.1Z 9172.548670 272 1 50.18 2 79.06 118.49 107.08 323.20 0.00 1 0.00 1 0 25 3.440e-01 6.956e-03 2.425e-01 4.754e-03 6.440092e-01 2.533772e-03 7.131571e-03 -6.000000e+00 1.929165e-01 224.80 -2.00 3.47 -2.00 321.26 0.00e+00 3.224896e-03 1.176576e-03 1.072550e-03 -6.000000e+00 8.604429e-03 276.35 -2.00 20.00 -2.00 320.77 0.00e+00 5.082 0.002 302.00 328.00 3 2.2445e+00 8.3409e-03 6.0748e-02 -6.0000e+00 4.7676e-01 1.1948e-01 1.1748e-02 3.6118e-02 -6.0000e+00 5.1985e-01 -8.9651e-02 1.2828e-02 1.8528e-02 -6.0000e+00 3.0849e-01 1.9102e-02 6.1603e-03 7.1554e-03 -6.0000e+00 1.3338e-01 1.8714e-04 -7.7870e-04 1.3488e-04 7.4451e-05 -6.0000e+00 8.9831e-03 2.1212e-02 0.0000e+00 11 9 0 11 8 0 99.79 21.45 0.41 0.02121 0.01536 93 18 1 5 0 539.520 24.46 19.99 21.45 7.85 23.2 931.27 900000 -108561 -113286 -100072 900000 -114717 -69058 -147142 -78172 -149437 -138010 -8956 -125562 -15844 -14085 -56910 -72600 -2885 -54370 15308 -54163 87 -34385 24413 -21518 -8615 -22748 20352 -7012 -17403 -3329 9904 -15988 12079 3075 -10676 4838 2923 6669 -951 6575 -3205 -1466 -5194 -3625 8040 -4496 -3371 2867 2746 6645 5204 -1626 5732 -451 3994 -744 3064 549 -1284 -1316 3765 2695 2486 1142 -233 2180 1861 635 -378 1630 28 3764 -328 2647 -525 603 -671 778 -521 -551 -1418 -1905 -1485 -77 773 -693 43 -1059 1362 307 692 1371 -100 -180 228 385 25 -124 -178 -274 570 222 -1721 -1077 -1329 -798 -853 296 -128 292 -130 -259 -3 333 905 480 30 -704 -9 -150 682 103 658 -252 534 1218 628 120 232 -64 -16 8 -224 -53 -276 167 -184 174 -603 121 59 900000 -640 -716 -506 900000 -676 -320 -1549 -461 -1888 -1686 -41 -2221 -120 -131 -935 -1560 -34 -1145 168 -1186 1 -695 298 -444 -163 -489 274 -130 -468 -94 289 -681 381 101 -435 197 149 402 -71 497 -284 -132 -493 -348 704 -460 -358 303 322 847 740 -271 953 -83 731 -144 554 99 -240 -268 830 687 687 314 -63 591 546 219 -148 660 11 1419 -118 828 -156 175 -216 294 -235 -286 -826 -1180 -977 -54 561 -528 32 -791 924 196 419 832 -68 -142 207 404 29 -146 -199 -277 512 197 -1684 -1111 -1442 -923 -1074 412 -199 485 -219 -421 -5 483 1301 723 48 -1194 -15 -243 1056 155 943 -352 710 1649 964 210 445 -132 -35 16 -498 -124 -664 408 -454 410 -1347 279 130 SS 20250210T131600.7Z 9172.552786 275 1 50.42 2 78.06 119.53 107.75 324.35 0.00 1 0.00 1 0 17 4.414e-01 1.876e-02 2.937e-01 1.378e-02 5.899527e-01 7.334034e-03 6.771862e-03 -6.000000e+00 2.464059e-01 224.80 -2.00 3.47 -2.00 321.05 0.00e+00 6.062186e-03 3.106663e-03 1.295202e-03 -6.000000e+00 1.110739e-02 276.35 -2.00 20.00 -2.00 320.54 0.00e+00 4.686 0.002 302.00 328.00 3 3.8147e+00 2.3237e-02 5.5287e-02 -6.0000e+00 6.0941e-01 3.1457e-01 2.9813e-02 3.0892e-02 -6.0000e+00 6.6432e-01 -3.6560e-01 2.7881e-02 1.7464e-02 -6.0000e+00 3.9529e-01 1.4936e-01 1.3727e-02 7.6831e-03 -6.0000e+00 1.7118e-01 5.6764e-05 -1.5920e-03 3.9843e-04 9.1213e-05 -6.0000e+00 1.1713e-02 2.3785e-02 0.0000e+00 12 9 8 11 8 0 99.98 21.47 0.01 0.02378 0.01182 69 13 1 5 0 730.590 24.56 19.99 21.47 8.11 23.2 933.13 -97638 900000 -78871 900000 -73851 -10693 -161758 -30427 -140006 46550 -106307 -91021 -58157 -90974 -63958 -34519 317215 -70723 14998 53325 57219 -57798 -4357 -52345 56861 65057 82700 -34530 3750 8262 -7683 27080 31628 55667 -11085 61831 31961 63204 -15 36644 4705 24960 9376 16553 4505 11114 5706 4829 7770 17961 25786 8850 17139 4375 15002 5638 10135 2600 7767 -2046 6438 3735 10773 5884 1395 8664 4343 4225 4165 5393 1361 675 -3587 3369 -2151 2483 -3145 -712 -1256 -3825 -2658 -4257 -1899 -4161 -1505 -2125 1410 -170 989 -165 -502 -2366 2163 -2229 -629 -122 -1548 -601 -1593 -417 -1359 1378 -917 -148 -2673 -1125 -212 809 -1400 1072 -1625 658 -143 -537 977 1355 1337 -73 1012 321 666 185 386 506 1281 500 2322 612 675 -181 779 661 29 -836 90 -553 -393 1021 -692 304 -1407 -285 -2077 900000 -1501 900000 -1075 -144 -6716 -409 -5471 625 -3116 -2779 -1633 -4444 -2890 -1307 4261 -4491 421 1042 1048 -3317 -154 -3132 1180 1271 1313 -1687 128 313 -403 1157 1429 1903 -690 1963 1561 2701 -1 2774 523 2377 1076 1779 556 1303 718 631 1025 2325 3432 1513 2909 892 2821 1191 2042 546 1508 -489 1391 1028 3126 1921 463 2572 1353 1402 1589 2275 629 314 -1653 1331 -800 804 -1056 -252 -528 -1932 -1517 -2728 -1252 -2985 -1126 -1684 1115 -138 769 -121 -341 -1547 1348 -1590 -509 -113 -1676 -713 -1930 -471 -1407 1250 -837 -145 -2851 -1239 -247 1011 -1986 1646 -2727 1082 -229 -810 1373 1887 1941 -115 1650 529 1056 285 573 716 1733 652 3028 907 1123 -332 1509 1337 61 -1929 216 -1372 -991 2549 -1691 693 -3078 -591 SS 20250210T133416.8Z 9172.565473 284 1 12.48 2 75.02 122.84 109.68 328.02 0.00 1 0.00 1 0 25 7.898e-02 6.716e-03 1.297e-01 5.392e-03 4.933841e-01 2.716862e-03 5.666510e-03 -6.000000e+00 4.408709e-02 224.80 -2.00 3.47 -2.00 319.93 0.00e+00 2.871502e-03 8.412835e-04 3.593576e-04 -6.000000e+00 1.918676e-03 276.35 -2.00 20.00 -2.00 319.36 0.00e+00 3.793 0.001 302.00 328.00 3 3.4200e+00 7.7858e-03 4.5030e-02 -6.0000e+00 1.0908e-01 8.4303e-02 9.4256e-03 2.5590e-02 -6.0000e+00 1.1887e-01 -3.9761e-02 8.4630e-03 1.2949e-02 -6.0000e+00 7.0681e-02 3.5967e-03 4.4332e-03 4.9281e-03 -6.0000e+00 3.0359e-02 2.2652e-04 -8.5573e-04 1.5090e-04 4.4187e-05 -6.0000e+00 2.0583e-03 1.9444e-02 0.0000e+00 12 9 1 12 1 1 98.97 21.55 0.38 0.01944 0.01301 9 8 1 5 0 1247.170 24.56 20.02 21.55 8.37 23.2 934.88 -29592 -39650 14118 -43204 -12698 30191 -5916 -21996 16530 15370 -14041 -12202 -1310 -8524 -10766 592 -12631 4196 6232 2479 -2075 279 -3830 7801 3350 -11864 -6213 -12233 -13341 532 5983 -2337 -3716 -7380 11584 -4006 7561 652 -1931 -3113 -3006 -769 578 -994 3531 139 -2309 -2632 283 3377 213 978 1391 2653 -866 -151 -1042 1622 -1010 476 1922 1393 -168 1513 2208 863 1683 -46 1223 -426 1002 -904 -137 667 291 -140 367 830 989 -1723 -1263 -774 -1333 -997 -1356 -640 -589 577 196 465 -118 1181 1963 1518 248 1011 703 -241 -739 -841 -255 553 1025 -1265 -470 -1461 -658 -231 -703 705 41 137 242 217 308 781 483 -432 -213 -294 -667 298 -104 627 208 600 786 955 -167 -110 -369 180 215 -489 -57 -247 409 84 -115 -572 120 25 -396 -644 148 -727 -147 238 -75 -370 209 202 -258 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