File name: Pandora2s1_GreenbeltMD_20231218_L2Fit_fout2c16d20230922p1-8.txt File generation date: 20250301T104516.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c16p1-8 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_v16d20230922.txt Level 1 file used: Pandora2s1_GreenbeltMD_20231218_L1_smca1c16d20230922p1-8.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: 20231218 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 20230922, based on session 14 after set temperature returned to 20C First and last pixel inside fitting window: 197 339 Nominal wavelengths inside fitting window [nm]: 305.0155 305.1566 305.2976 305.4387 305.5797 305.7207 305.8617 306.0027 306.1437 306.2847 306.4256 306.5666 306.7075 306.8485 306.9894 307.1303 307.2712 307.4121 307.5529 307.6938 307.8347 307.9755 308.1163 308.2571 308.3979 308.5387 308.6795 308.8203 308.9611 309.1018 309.2426 309.3833 309.5240 309.6647 309.8054 309.9461 310.0868 310.2274 310.3681 310.5087 310.6493 310.7900 310.9306 311.0712 311.2117 311.3523 311.4929 311.6334 311.7740 311.9145 312.0550 312.1955 312.3360 312.4765 312.6170 312.7574 312.8979 313.0383 313.1787 313.3192 313.4596 313.5999 313.7403 313.8807 314.0211 314.1614 314.3017 314.4421 314.5824 314.7227 314.8630 315.0033 315.1435 315.2838 315.4240 315.5643 315.7045 315.8447 315.9849 316.1251 316.2653 316.4054 316.5456 316.6857 316.8259 316.9660 317.1061 317.2462 317.3863 317.5264 317.6664 317.8065 317.9465 318.0865 318.2266 318.3666 318.5066 318.6466 318.7865 318.9265 319.0664 319.2064 319.3463 319.4862 319.6261 319.7660 319.9059 320.0458 320.1856 320.3255 320.4653 320.6052 320.7450 320.8848 321.0246 321.1643 321.3041 321.4439 321.5836 321.7233 321.8631 322.0028 322.1425 322.2822 322.4218 322.5615 322.7012 322.8408 322.9804 323.1201 323.2597 323.3993 323.5388 323.6784 323.8180 323.9575 324.0971 324.2366 324.3761 324.5156 324.6551 324.7946 324.9341 --------------------------------------------------------------------------------------- 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 20231218T143609.5Z 8752.608443 109 1 50.39 2 71.31 144.39 116.62 82.55 0.00 1 0.00 1 0 17 4.725e-02 5.058e-03 6.026e-03 4.331e-04 4.317176e-01 2.161474e-04 5.016933e-03 -6.000000e+00 2.618280e-02 223.18 -2.00 3.47 -2.00 319.48 0.00e+00 1.128871e-03 5.882332e-05 3.385707e-04 -6.000000e+00 1.151752e-03 278.13 -2.00 20.00 -2.00 318.87 0.00e+00 3.083 0.000 302.00 328.00 3 1.0317e+00 6.0734e-04 3.7323e-02 -6.0000e+00 6.4510e-02 3.7090e-02 7.1550e-04 2.1732e-02 -6.0000e+00 7.0360e-02 -1.1387e-02 5.7836e-04 1.1066e-02 -6.0000e+00 4.1951e-02 -4.5670e-03 3.0604e-04 3.4612e-03 -6.0000e+00 1.7955e-02 5.2527e-03 -2.8369e-04 1.2298e-05 3.6317e-05 -6.0000e+00 1.2211e-03 1.1097e-02 2.3548e-05 10 0 0 10 0 0 99.57 22.12 0.24 0.01110 0.00897 1232 236 1 5 0 40.860 25.07 19.92 22.12 16.00 19.3 962.86 -17996 -15321 -12207 -15744 -17464 -17655 -18295 -13186 -12125 -10983 -15633 -10163 -10253 -7544 -4763 -3416 -3470 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72 272 43 572 1087 464 -367 -327 -927 -1006 -78 -930 -1296 -1155 -807 -649 536 464 495 90 202 -240 162 183 264 334 170 -133 336 681 333 956 209 211 796 534 118 48 -404 -458 -310 -155 -198 -122 920 192 17 -152 -621 -789 SS 20231218T144132.4Z 8752.612180 112 1 48.55 2 70.71 145.53 115.61 83.41 0.00 1 0.00 1 0 17 6.370e-02 5.994e-03 5.553e-02 3.663e-03 4.179590e-01 1.814372e-03 4.843340e-03 -6.000000e+00 3.529207e-02 223.18 -2.00 3.47 -2.00 319.70 0.00e+00 1.494023e-03 5.256882e-04 4.928534e-04 -6.000000e+00 1.552471e-03 278.13 -2.00 20.00 -2.00 319.09 0.00e+00 2.993 0.000 302.00 328.00 3 4.5837e+00 5.1193e-03 3.6197e-02 -6.0000e+00 8.6953e-02 5.4703e-02 6.1026e-03 2.1079e-02 -6.0000e+00 9.4841e-02 -1.7161e-02 5.0553e-03 1.0850e-02 -6.0000e+00 5.6547e-02 -5.8869e-04 2.6596e-03 3.5091e-03 -6.0000e+00 2.4201e-02 1.6514e-04 -3.0498e-04 1.0521e-04 3.7146e-05 -6.0000e+00 1.6460e-03 1.1543e-02 2.1706e-05 12 1 1 12 9 1 100.00 22.17 0.10 0.01154 0.00925 78 16 1 5 0 614.400 25.07 19.79 22.17 16.19 19.3 964.24 -15982 4420 17357 -23665 -12728 -25445 -16814 -32461 -3530 -28157 -7003 -15531 -17271 -12105 -13206 -3526 -11316 3797 -2512 1707 -5421 1960 -8573 -1640 -4418 2872 224 -3431 -8181 -6290 1379 287 1199 -3645 1916 -1052 -846 73 -100 -1139 497 -2205 -1107 -727 1572 -1125 1173 -162 -1026 -72 938 1830 1350 1487 368 1740 26 1169 -817 774 1467 2460 1652 1993 1992 -510 122 -877 1043 -92 472 685 411 456 843 -821 -25 -1764 -945 -958 -157 -1380 -1871 -1490 -650 -317 -244 99 1261 292 259 625 -269 -256 -300 84 258 1059 500 -528 -89 -1196 -941 -292 -709 -1058 -334 -1214 -164 97 326 259 480 267 -23 -16 -93 151 314 196 -300 176 688 525 232 338 148 604 459 297 -172 -303 -845 -106 137 -209 130 611 85 -72 57 -638 -311 -291 76 282 -569 -244 -521 -333 -843 -78 -869 -177 -444 -589 -476 -630 -179 -676 208 -157 107 -414 138 -683 -131 -388 247 20 -310 -728 -551 124 29 137 -475 224 -121 -105 10 -17 -240 116 -562 -292 -195 413 -307 313 -44 -281 -20 277 588 468 552 145 695 11 483 -335 307 591 1060 796 1056 1095 -271 61 -437 541 -55 314 478 288 305 521 -462 -13 -875 -493 -576 -108 -1077 -1594 -1325 -612 -320 -258 108 1369 310 254 562 -227 -212 -267 83 290 1334 686 -727 -114 -1418 -1021 -318 -845 -1339 -440 -1702 -242 141 513 423 766 403 -35 -23 -134 227 502 332 -517 295 1115 819 345 481 200 825 688 488 -303 -560 -1470 -191 263 -422 268 1282 181 -148 111 -1197 -621 SS 20231218T145036.2Z 8752.618475 118 1 6.30 2 69.74 147.49 113.90 84.83 0.00 1 0.00 1 0 17 5.079e-02 6.777e-03 3.242e-02 4.078e-03 4.017981e-01 2.005693e-03 4.722240e-03 -6.000000e+00 2.814107e-02 223.18 -2.00 3.47 -2.00 318.59 0.00e+00 7.192996e-04 4.210107e-04 2.007708e-04 -6.000000e+00 1.237873e-03 278.12 -2.00 20.00 -2.00 317.97 0.00e+00 2.858 0.000 302.00 328.00 3 3.9971e+00 5.4173e-03 3.4602e-02 -6.0000e+00 6.9335e-02 4.5411e-02 6.2160e-03 2.0089e-02 -6.0000e+00 7.5625e-02 -1.4880e-02 4.4081e-03 1.0088e-02 -6.0000e+00 4.5090e-02 -7.3090e-04 2.3465e-03 2.9955e-03 -6.0000e+00 1.9297e-02 3.4681e-04 -3.1772e-04 1.1244e-04 3.0838e-05 -6.0000e+00 1.3125e-03 1.1104e-02 -3.4239e-06 12 9 1 12 1 1 99.16 22.07 0.13 0.01110 0.00872 6 11 1 5 0 899.460 25.07 19.86 22.07 16.29 19.2 964.18 -10063 -22498 17995 -15339 3926 -26936 -12351 -25348 1519 -1042 -9250 -719 -18701 3839 -2420 5750 -4147 1664 -6807 2647 -319 5261 -2311 1376 -491 900 -373 -678 -285 -1733 6107 1636 4650 -4079 384 -5415 -1789 -3376 1161 -1394 -687 -274 354 -1857 -1839 1746 715 911 -1687 1989 1969 1383 -532 1587 617 1740 214 1113 -381 919 633 1600 1215 1666 560 -407 436 -1414 61 559 721 461 497 -271 4 20 -1385 -2003 -1110 -291 -1168 -631 -2156 -1556 -804 132 -408 1096 365 464 -6 524 -136 230 681 98 990 747 -25 -271 37 -836 -347 -731 -464 -1272 -1031 -602 -337 36 549 747 243 10 -205 158 -228 -61 46 139 47 647 147 431 301 587 29 669 504 56 155 -171 -508 -607 94 -141 305 420 14 -59 83 -393 -633 -352 -1029 587 -683 128 -1125 -472 -1240 65 -50 -486 -36 -1294 255 -204 519 -449 181 -855 317 -41 628 -303 188 -73 139 -60 -105 -41 -252 904 284 878 -909 78 -1105 -381 -849 308 -456 -251 -106 141 -774 -766 708 292 370 -705 816 867 672 -259 810 334 956 123 634 -215 502 354 955 805 1116 392 -294 294 -959 43 416 595 401 433 -228 3 15 -961 -1342 -779 -215 -996 -559 -2105 -1582 -867 142 -463 1264 427 525 -6 539 -131 215 680 110 1167 932 -34 -366 47 -1040 -395 -846 -582 -1598 -1352 -831 -493 53 878 1233 394 15 -310 224 -321 -90 67 217 74 996 221 661 439 817 38 893 736 84 251 -289 -835 -1042 171 -257 565 793 27 -109 153 -698 -1095 SS 20231218T150024.2Z 8752.625280 121 1 50.53 2 68.75 149.64 112.05 86.34 0.00 1 0.00 1 0 17 2.658e-02 5.303e-03 2.478e-03 2.911e-04 3.805851e-01 1.434457e-04 4.476408e-03 -6.000000e+00 1.472810e-02 223.18 -2.00 3.47 -2.00 318.86 0.00e+00 8.447237e-04 3.217096e-05 2.752183e-04 -6.000000e+00 6.478659e-04 278.12 -2.00 20.00 -2.00 318.23 0.00e+00 2.733 0.000 302.00 328.00 3 8.2388e-01 3.9124e-04 3.3001e-02 -6.0000e+00 3.6288e-02 2.8424e-02 4.5131e-04 1.9091e-02 -6.0000e+00 3.9578e-02 -8.2056e-03 3.2793e-04 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