File name: Pandora31s1_CharlesCityVA_20250726_L2Fit_fout2c7d20240321p1-8.txt File generation date: 20250727T053049.5Z 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_20250726_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: 20250726 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 20250726T105624.9Z 9338.455844 77 1 29.82 2 82.04 71.73 101.24 61.48 0.00 1 0.00 1 0 25 7.579e-01 4.212e-02 3.327e-01 1.663e-02 7.867801e-01 1.007875e-02 1.068573e-02 -6.000000e+00 4.645657e-01 232.24 -2.00 3.44 -2.00 321.84 0.00e+00 2.093618e-02 5.783560e-03 9.395658e-03 -6.000000e+00 2.888393e-02 291.70 -2.00 20.00 -2.00 321.26 0.00e+00 6.739 0.005 302.00 328.00 3 2.7628e+00 3.9717e-02 8.6123e-02 -6.0000e+00 1.1726e+00 1.0170e+00 5.3582e-02 5.6625e-02 -6.0000e+00 1.2831e+00 -1.2109e+00 4.2718e-02 3.7042e-02 -6.0000e+00 7.5541e-01 4.5593e-01 1.9526e-02 1.6688e-02 -6.0000e+00 3.2586e-01 1.4942e-05 7.5286e-04 4.8571e-04 3.2655e-04 -6.0000e+00 2.3144e-02 2.1652e-02 12 8 8 10 0 0 24.83 24.32 1.32 0.02165 0.02731 11 11 1 5 0 2710.740 26.83 20.00 24.32 35.76 1.3 1017.55 900000 900000 900000 900000 900000 43147 900000 -117176 -165926 900000 -83894 900000 900000 -16462 -83964 900000 -35209 900000 101643 -48873 900000 -3372 85695 900000 27705 900000 900000 900000 -3353 900000 900000 125946 900000 900000 900000 -22921 900000 209120 -16349 427433 85903 32263 -5180 302903 900000 83090 239533 88359 -28888 73656 139801 138340 53369 88277 24127 168953 64993 2144 20042 71879 183844 71961 49422 69246 42254 18088 39739 -1356 -8866 11363 53365 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-2202 -545 -2096 -2569 -129 3981 5185 -9044 3851 -965 1321 1996 2663 1689 2961 2014 -2406 2909 -801 -2403 443 3566 2853 1478 3184 -2406 1814 -1415 1624 -3334 -208 -1475 -3601 SS 20250726T110441.1Z 9338.461587 81 1 30.06 2 80.48 72.91 99.86 62.85 0.00 1 0.00 1 0 17 5.028e-01 1.628e-02 2.661e-01 7.208e-03 7.303831e-01 4.133808e-03 8.703498e-03 -6.000000e+00 2.976474e-01 232.24 -2.00 3.44 -2.00 321.43 0.00e+00 9.517633e-03 2.195825e-03 4.796424e-03 -6.000000e+00 1.606947e-02 291.70 -2.00 20.00 -2.00 320.79 0.00e+00 5.753 0.003 302.00 328.00 3 2.6716e+00 1.5257e-02 7.1316e-02 -6.0000e+00 7.4615e-01 2.4176e-01 2.1741e-02 4.4583e-02 -6.0000e+00 8.0961e-01 -2.4938e-01 2.1200e-02 2.7565e-02 -6.0000e+00 4.8243e-01 7.8584e-02 9.8569e-03 1.1061e-02 -6.0000e+00 2.1141e-01 5.3108e-05 -2.2392e-04 2.0500e-04 1.7091e-04 -6.0000e+00 1.4494e-02 2.2377e-02 12 8 8 10 0 0 26.39 24.33 0.80 0.02238 0.02069 23 23 1 5 0 1306.820 26.83 20.00 24.33 36.74 1.3 1021.65 900000 900000 900000 900000 900000 -221650 900000 -228284 -225361 -152243 -126990 900000 62265 -53660 -145022 900000 -76750 900000 -76402 -111320 900000 101689 -59334 900000 -32039 81160 120939 -67536 -12575 -2835 900000 -21705 42621 -4904 79137 -72529 900000 61664 -1156 -3282 -4784 -13729 -14961 60294 10900 4101 25638 4210 -20811 15698 11490 10997 24055 20111 11301 18767 8061 -10503 -3511 8440 22878 9478 9889 11350 9583 4488 8938 4756 -7748 1178 9099 4860 316 8572 -6406 6505 4671 -958 -10405 -2054 421 -3806 -3312 984 -393 -5912 -1001 -729 1608 4068 -663 -440 49 -3350 -841 2446 -686 -899 -339 -510 -2219 33 -1150 766 -59 -2464 -753 1150 1826 -696 528 -998 9 -177 696 383 1532 -852 1001 496 -332 1017 -232 -140 831 593 -261 79 305 -667 106 -255 170 111 438 -680 879 70 -144 -407 -181 -312 -83 900000 900000 900000 900000 900000 -2921 900000 -3775 -3974 -1390 -960 900000 437 -428 -3663 900000 -1393 900000 -1694 -3648 900000 713 -1243 900000 -577 569 848 -1800 -203 -48 900000 -671 823 -159 1083 -4314 900000 1336 -55 -189 -310 -1040 -1214 2480 738 307 1629 345 -2292 1333 1142 1227 2597 2442 1566 2514 1216 -1868 -570 1221 3046 1592 1900 2424 2180 1058 2027 1174 -2384 381 2981 1711 114 2691 -2111 1722 1202 -270 -3646 -790 184 -1960 -1844 557 -239 -4003 -676 -503 1087 2591 -415 -259 28 -2070 -573 1860 -616 -915 -370 -556 -2323 31 -1005 662 -54 -2445 -774 1246 2140 -923 759 -1529 14 -265 994 534 2133 -1259 1530 784 -524 1536 -343 -202 1149 798 -347 108 466 -1141 195 -497 345 237 984 -1604 2084 168 -350 -960 -407 -670 -173 SS 20250726T111705.2Z 9338.470199 87 1 29.94 2 78.11 74.66 97.76 64.85 0.00 1 0.00 1 0 17 2.493e-01 7.103e-03 1.818e-01 3.156e-03 6.166538e-01 1.687722e-03 6.910286e-03 -6.000000e+00 1.448090e-01 232.24 -2.00 3.44 -2.00 320.69 0.00e+00 2.491712e-03 7.145013e-04 1.179008e-03 -6.000000e+00 6.567047e-03 291.70 -2.00 20.00 -2.00 319.96 0.00e+00 4.701 0.002 302.00 328.00 3 2.4662e+00 5.4787e-03 5.7105e-02 -6.0000e+00 3.6259e-01 3.1207e-02 7.1873e-03 3.2604e-02 -6.0000e+00 3.9180e-01 -3.7041e-02 6.6660e-03 1.6839e-02 -6.0000e+00 2.3381e-01 1.9118e-03 3.2875e-03 5.4338e-03 -6.0000e+00 1.0004e-01 2.1199e-04 -3.0574e-04 8.7935e-05 6.3498e-05 -6.0000e+00 6.7961e-03 2.1535e-02 11 8 0 10 0 0 48.40 24.35 0.41 0.02154 0.01924 50 50 1 5 0 598.590 26.83 20.01 24.35 38.10 1.3 1026.48 900000 119451 -101173 25822 -50240 -12529 -76426 -90837 -114852 718 -63940 -36036 -58419 -82401 -33594 31123 -28665 846 -33900 -50855 30121 -16196 -3840 13760 -17366 -8086 -7038 -16358 -15255 12773 4171 968 4067 -3303 12685 -37914 44053 -8279 998 -6245 2632 -4547 -875 1778 3240 -3454 1044 -2705 -8072 5710 3192 4955 3865 4448 1727 5301 82 -2848 -302 1864 3710 2480 2447 2589 1783 1862 2030 -1046 -735 1164 2456 266 -646 218 -2177 1173 -208 975 -3864 1126 -966 -999 -1552 -672 -664 -1440 415 -66 715 298 735 105 767 -768 588 416 686 -282 -395 -117 -820 -510 -904 258 -989 -756 -836 57 70 284 68 -42 206 128 583 367 671 -8 361 -350 -33 -121 -34 275 -15 596 177 626 98 -303 52 134 -254 78 -208 -177 161 127 -107 -260 114 -124 9 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