File name: Pandora31s1_CharlesCityVA_20250626_L2Fit_fout2c7d20240321p1-8.txt File generation date: 20250627T052445.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c7p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 31 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora31_OF_v2d20240301.txt Instrument calibration file used: Pandora31s1_CF_v7d20240321.txt Level 1 file used: Pandora31s1_CharlesCityVA_20250626_L1_smca1c7d20240321p1-8.txt Full location name: Richmond VCU Short location name: CharlesCityVA Country of location: USA Location latitude [deg]: 37.3260 Location longitude [deg]: -77.2057 Location altitude [m]: 6 Local noon date: 20250626 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: None First and last pixel inside fitting window: 253 395 Nominal wavelengths inside fitting window [nm]: 305.0651 305.2060 305.3469 305.4877 305.6285 305.7694 305.9101 306.0509 306.1917 306.3324 306.4731 306.6138 306.7545 306.8952 307.0358 307.1765 307.3171 307.4577 307.5983 307.7388 307.8794 308.0199 308.1604 308.3009 308.4414 308.5819 308.7223 308.8628 309.0032 309.1436 309.2840 309.4243 309.5647 309.7050 309.8454 309.9857 310.1260 310.2662 310.4065 310.5467 310.6870 310.8272 310.9674 311.1076 311.2477 311.3879 311.5280 311.6682 311.8083 311.9484 312.0884 312.2285 312.3686 312.5086 312.6486 312.7886 312.9286 313.0686 313.2086 313.3485 313.4885 313.6284 313.7683 313.9082 314.0481 314.1879 314.3278 314.4676 314.6075 314.7473 314.8871 315.0269 315.1666 315.3064 315.4461 315.5859 315.7256 315.8653 316.0050 316.1447 316.2843 316.4240 316.5636 316.7032 316.8428 316.9824 317.1220 317.2616 317.4012 317.5407 317.6802 317.8198 317.9593 318.0988 318.2383 318.3777 318.5172 318.6566 318.7961 318.9355 319.0749 319.2143 319.3537 319.4930 319.6324 319.7717 319.9111 320.0504 320.1897 320.3290 320.4683 320.6075 320.7468 320.8860 321.0253 321.1645 321.3037 321.4429 321.5821 321.7212 321.8604 321.9996 322.1387 322.2778 322.4169 322.5560 322.6951 322.8342 322.9732 323.1123 323.2513 323.3904 323.5294 323.6684 323.8074 323.9463 324.0853 324.2243 324.3632 324.5021 324.6411 324.7800 324.9189 --------------------------------------------------------------------------------------- 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: 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 77: 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 78: 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 79: 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 80: 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 81: 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 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Temperature at electronics board [°C], 999=no temperature signal Column 94: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Humidity in head sensor [%], -9=no humidity signal Column 98: Pressure in head sensor [hPa], -9=no pressure signal Columns 99-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-384: 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 20250626T103704.8Z 9308.442416 80 1 30.93 2 82.53 66.27 91.96 54.83 0.00 1 0.00 1 0 25 6.027e-01 4.709e-02 3.550e-01 1.969e-02 8.130570e-01 1.223835e-02 1.283251e-02 -6.000000e+00 3.790176e-01 232.75 -2.00 3.44 -2.00 321.85 0.00e+00 2.816718e-02 6.650676e-03 1.403091e-02 -6.000000e+00 2.283937e-02 289.73 -2.00 20.00 -2.00 321.29 0.00e+00 7.114 0.006 302.00 328.00 3 2.5200e+00 4.6381e-02 9.9353e-02 -6.0000e+00 9.7590e-01 1.2224e+00 6.2099e-02 7.4791e-02 -6.0000e+00 1.0755e+00 -1.2786e+00 5.2397e-02 4.4337e-02 -6.0000e+00 6.2285e-01 4.6182e-01 2.4466e-02 1.7982e-02 -6.0000e+00 2.6208e-01 1.1388e-05 2.9915e-04 5.7367e-04 4.2055e-04 -6.0000e+00 1.9909e-02 1.6495e-02 12 8 8 10 0 0 -146.50 24.40 1.67 0.01649 0.01874 10 10 1 5 0 3092.340 26.94 20.00 24.40 35.18 0.9 1019.37 900000 900000 900000 900000 43029 189217 900000 900000 -167206 900000 900000 900000 -23061 27268 900000 900000 900000 900000 900000 -74581 900000 -80272 -15822 900000 -28196 3462 900000 900000 900000 900000 164637 900000 123491 900000 900000 900000 900000 900000 900000 90916 37864 33084 431 159087 98992 3377 178370 16640 -15472 43382 166616 170936 182067 111102 30695 900000 2908 3538 -11829 116347 220747 45735 40941 39904 15761 19241 72985 -487 32935 11955 72696 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-2809 -279 2406 1074 -618 8120 3467 -8047 8858 -1291 -1362 1443 2263 3205 392 34 1076 1074 -6517 2473 2621 3852 3288 -605 -15 -206 3486 -2118 -2643 -9698 1054 3031 1084 SS 20250626T104517.8Z 9308.448123 84 1 29.67 2 81.03 67.42 90.68 56.04 0.00 1 0.00 1 0 17 4.872e-01 1.777e-02 3.161e-01 7.885e-03 7.509251e-01 4.608116e-03 8.651295e-03 -6.000000e+00 2.948710e-01 232.75 -2.00 3.44 -2.00 321.58 0.00e+00 5.897657e-03 2.518652e-03 4.510868e-03 -6.000000e+00 1.496799e-02 289.73 -2.00 20.00 -2.00 320.99 0.00e+00 6.067 0.004 302.00 328.00 3 2.4952e+00 1.7260e-02 7.4938e-02 -6.0000e+00 7.4435e-01 2.2639e-01 2.5260e-02 4.7351e-02 -6.0000e+00 8.1104e-01 -3.1855e-01 2.5121e-02 2.6731e-02 -6.0000e+00 4.8042e-01 1.1928e-01 1.1496e-02 8.8623e-03 -6.0000e+00 2.0316e-01 4.8456e-05 -2.0605e-04 2.2616e-04 1.4103e-04 -6.0000e+00 1.4204e-02 1.7842e-02 12 8 8 10 0 0 -28.98 24.39 0.90 0.01784 0.01629 25 25 1 5 0 1186.540 26.94 19.99 24.39 35.45 0.9 1020.00 900000 900000 -102585 900000 900000 62970 900000 -261295 -240561 -120407 -125046 -191027 -44098 68963 900000 15494 900000 900000 900000 -139026 900000 14376 -21048 900000 -121795 900000 68717 91509 -67913 900000 -14259 5506 -37257 80367 900000 -37336 900000 22434 26470 -8844 20798 -10910 -4402 33417 22968 4989 24640 14759 -30622 5258 12685 23898 14944 24489 2832 42869 7095 -1834 214 11791 33904 5177 10042 6575 3150 988 9743 903 3571 6274 12405 5365 3897 8083 -8030 7997 496 1158 -5719 721 -4103 -1031 -2067 1844 -1415 -6936 -1553 2068 2191 2335 1239 -4835 2507 -2966 -2365 407 863 -776 -1092 -1272 -1448 328 -3031 3579 -1758 -3256 -2029 2366 885 -61 -644 -599 1 -132 -123 1799 1642 -1545 1110 -755 1312 1147 -176 573 1070 -181 402 692 -603 97 106 380 -134 205 465 -615 715 -230 -237 -904 354 -173 -299 900000 900000 -786 900000 900000 483 900000 -5646 -4695 -923 -959 -3062 -338 529 900000 119 900000 900000 900000 -5329 900000 120 -264 900000 -4839 900000 527 702 -1657 900000 -288 111 -1350 952 900000 -1379 900000 610 849 -481 942 -730 -291 1560 1217 327 1374 957 -3329 436 1105 2099 1583 2577 393 4153 1009 -283 31 1520 3663 834 1630 1256 658 208 1892 201 869 1720 3519 1697 1227 2288 -2421 1845 117 282 -1713 244 -1722 -483 -1076 983 -835 -4254 -948 1252 1322 1466 735 -2870 1348 -1770 -1598 290 717 -758 -1171 -1371 -1467 293 -2554 2831 -1576 -3139 -2049 2469 1038 -77 -906 -901 1 -195 -173 2401 2218 -2262 1679 -1208 2031 1706 -256 799 1428 -237 547 914 -920 167 204 732 -276 448 1088 -1440 1692 -558 -575 -2122 820 -377 -629 SS 20250626T110038.4Z 9308.458778 92 1 29.90 2 78.19 69.54 88.24 58.25 0.00 1 0.00 1 0 17 2.704e-01 6.049e-03 1.435e-01 2.379e-03 6.184403e-01 1.273738e-03 6.895622e-03 -6.000000e+00 1.574555e-01 232.75 -2.00 3.44 -2.00 320.72 0.00e+00 2.719227e-03 5.416898e-04 1.174642e-03 -6.000000e+00 7.134228e-03 289.73 -2.00 20.00 -2.00 320.01 0.00e+00 4.730 0.002 302.00 328.00 3 1.9245e+00 4.1302e-03 5.7461e-02 -6.0000e+00 3.9506e-01 -1.6977e-03 5.4474e-03 3.2807e-02 -6.0000e+00 4.2666e-01 -2.7049e-02 5.1614e-03 1.7194e-02 -6.0000e+00 2.5431e-01 8.0644e-04 2.5347e-03 5.8400e-03 -6.0000e+00 1.0811e-01 3.6049e-04 -2.8379e-04 6.6151e-05 6.5986e-05 -6.0000e+00 7.4592e-03 1.7525e-02 10 0 0 10 0 0 -11.25 24.38 0.33 0.01753 0.01539 88 88 1 5 0 339.750 26.94 20.00 24.38 36.30 0.9 1024.53 -98245 -68811 -84433 900000 -56020 79471 -143785 -90531 -116423 56037 -72607 -77459 -26498 -36179 -16375 -17328 38784 -28552 -2681 -47490 36101 -25063 6662 -783 -14446 -10507 -5908 -7265 -15808 12580 -11297 11528 -8707 3123 5013 -4545 18538 -2773 469 -4882 696 -4410 -3028 -1770 2655 -5709 3860 468 -2258 -1216 927 -233 2702 3894 -2000 4639 -1163 550 -1620 2700 1240 1629 2295 2441 2180 -124 805 -576 2282 372 3060 59 267 360 -515 -1008 -1902 -514 -1343 116 -1293 -689 -1391 -540 -1032 -878 283 1080 876 378 1020 -313 919 -371 615 -152 696 139 146 -725 -541 -874 -919 280 -1018 -911 -1061 -45 -318 192 -91 136 358 -77 132 329 957 -206 275 -183 251 115 127 -93 494 216 535 346 -261 149 85 220 -371 114 -259 -204 107 216 -155 -293 146 -122 7 -642 -431 -605 900000 -299 184 -1880 -882 -1522 156 -775 -915 -264 -465 -218 -278 441 -644 -51 -1502 561 -661 136 -19 -436 -324 -177 -215 -507 334 -457 443 -474 160 242 -244 891 -199 40 -485 73 -527 -376 -223 327 -786 495 64 -334 -192 160 -46 564 876 -506 1148 -315 146 -429 680 331 443 705 838 782 -44 281 -211 904 173 1531 32 141 181 -239 -422 -753 -204 -602 61 -744 -449 -999 -408 -841 -713 239 933 758 316 847 -246 684 -288 526 -141 741 159 182 -909 -635 -994 -962 293 -1161 -1031 -1270 -57 -442 278 -146 217 568 -124 202 480 1398 -319 451 -296 404 190 204 -144 728 308 779 491 -416 251 157 410 -729 236 -547 -454 243 501 -364 -663 311 -259 14 SS 20250626T111120.5Z 9308.466209 95 1 29.95 2 76.19 71.00 86.50 59.76 0.00 1 0.00 1 0 17 1.140e-01 4.225e-03 3.503e-02 1.293e-03 5.443037e-01 6.781235e-04 6.105995e-03 -6.000000e+00 6.637036e-02 232.75 -2.00 3.44 -2.00 320.11 0.00e+00 1.293122e-03 2.349910e-04 4.469403e-04 -6.000000e+00 2.960302e-03 289.74 -2.00 20.00 -2.00 319.36 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