File name: Pandora257s1_AustinTX_20240720_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240721T064630.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Paul Walter Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 257 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20240720_L1_smca1c2d20230110p1-8.txt Full location name: St. Edward's University Short location name: AustinTX Country of location: United States Location latitude [deg]: 30.2285 Location longitude [deg]: -97.7544 Location altitude [m]: 205 Local noon date: 20240720 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: OOB session based on clearance session 1 First and last pixel inside fitting window: 228 370 Nominal wavelengths inside fitting window [nm]: 305.0779 305.2183 305.3587 305.4991 305.6395 305.7799 305.9203 306.0607 306.2010 306.3413 306.4817 306.6220 306.7623 306.9026 307.0429 307.1832 307.3234 307.4637 307.6039 307.7442 307.8844 308.0246 308.1648 308.3050 308.4452 308.5854 308.7255 308.8657 309.0058 309.1459 309.2860 309.4261 309.5662 309.7063 309.8464 309.9865 310.1265 310.2665 310.4066 310.5466 310.6866 310.8266 310.9666 311.1065 311.2465 311.3865 311.5264 311.6663 311.8062 311.9461 312.0860 312.2259 312.3658 312.5057 312.6455 312.7854 312.9252 313.0650 313.2048 313.3446 313.4844 313.6242 313.7639 313.9037 314.0434 314.1832 314.3229 314.4626 314.6023 314.7420 314.8816 315.0213 315.1610 315.3006 315.4402 315.5799 315.7195 315.8591 315.9986 316.1382 316.2778 316.4173 316.5569 316.6964 316.8359 316.9754 317.1149 317.2544 317.3939 317.5334 317.6728 317.8123 317.9517 318.0911 318.2305 318.3699 318.5093 318.6487 318.7880 318.9274 319.0667 319.2061 319.3454 319.4847 319.6240 319.7633 319.9025 320.0418 320.1810 320.3203 320.4595 320.5987 320.7379 320.8771 321.0163 321.1555 321.2946 321.4338 321.5729 321.7121 321.8512 321.9903 322.1294 322.2685 322.4075 322.5466 322.6856 322.8247 322.9637 323.1027 323.2417 323.3807 323.5197 323.6587 323.7976 323.9366 324.0755 324.2144 324.3533 324.4922 324.6311 324.7700 324.9089 --------------------------------------------------------------------------------------- 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 20240720T124255.5Z 8967.529809 198 1 54.56 2 78.72 72.72 115.00 251.17 0.00 1 0.00 1 0 25 5.740e-01 1.086e-02 2.030e-01 2.480e-03 6.660377e-01 1.447353e-03 7.191917e-03 -6.000000e+00 3.688704e-01 230.04 -2.00 3.25 -2.00 320.86 0.00e+00 1.618978e-03 7.016503e-04 3.142851e-03 -6.000000e+00 1.929972e-02 293.20 -2.00 20.00 -2.00 320.14 0.00e+00 4.936 0.001 302.00 328.00 3 2.6757e+00 4.9932e-03 5.9863e-02 -6.0000e+00 9.1734e-01 3.7714e-02 6.7201e-03 3.8239e-02 -6.0000e+00 9.9166e-01 -8.1496e-02 6.0222e-03 1.8146e-02 -6.0000e+00 5.9234e-01 2.2585e-02 2.8693e-03 4.5373e-03 -6.0000e+00 2.4828e-01 1.4789e-04 -1.0785e-04 8.0917e-05 9.3253e-05 -6.0000e+00 2.1002e-02 2.7883e-02 -6.5204e-05 12 8 8 10 0 0 71.93 28.18 0.58 0.02788 0.02707 81 8 1 5 0 673.440 36.00 20.00 28.18 32.14 0.0 984.32 900000 16165 900000 900000 -225743 -141179 -178557 -159672 -69462 -178764 900000 -69711 -77126 130770 -2349 -32649 78903 288259 900000 272921 900000 1167 900000 -2347 11392 -56149 -31404 -31597 -39125 -7858 1868 6372 -25676 14375 -25507 236747 -17872 -7529 -10612 12716 764 -72 24002 -10430 510 -7886 -2267 10077 5050 3750 13526 11122 1550 16540 -4249 24 1489 -645 2319 121 -3267 -102 7860 459 -3036 -521 8715 5079 -333 707 3568 2581 -1084 1969 1957 682 3549 -4632 549 -29 -2322 -1877 -3043 -610 362 -646 -718 70 681 1280 -1566 -478 -604 695 -452 1164 581 19 -657 -1062 -570 -1058 -867 62 -311 -1801 -679 -49 -230 1283 497 -110 109 437 -145 287 304 439 154 -207 -52 -91 549 1568 -268 -293 294 68 877 -335 -316 -385 5 -246 -147 -119 -284 342 780 176 -279 -441 -316 900000 39 900000 900000 -4114 -1147 -2313 -1928 -381 -3258 900000 -582 -864 316 -19 -465 419 696 900000 659 900000 19 900000 -45 204 -2061 -918 -939 -1313 -214 54 203 -1259 500 -1361 972 -1057 -476 -828 915 69 -7 1965 -1244 56 -966 -271 1115 626 513 1859 1741 293 2920 -982 6 347 -154 534 29 -847 -28 2215 138 -989 -168 2608 1666 -127 297 1574 1192 -514 860 791 258 1258 -1844 231 -14 -1344 -1222 -2018 -425 267 -510 -593 58 562 1015 -1211 -348 -434 515 -376 1089 577 22 -787 -1282 -653 -1130 -873 62 -324 -2019 -802 -62 -297 1802 766 -168 166 697 -224 429 457 682 250 -324 -81 -148 861 2343 -392 -416 413 101 1404 -562 -580 -714 10 -513 -306 -259 -638 776 1750 384 -582 -934 -655 SS 20240720T124826.6Z 8967.533641 201 1 54.73 2 77.59 73.34 116.07 251.68 0.00 1 0.00 1 0 17 2.733e-01 7.813e-03 7.613e-02 1.551e-03 6.199773e-01 8.753608e-04 6.552393e-03 -6.000000e+00 1.750064e-01 230.04 -2.00 3.25 -2.00 320.31 0.00e+00 8.149682e-04 3.496937e-04 1.378162e-03 -6.000000e+00 8.211759e-03 293.20 -2.00 20.00 -2.00 319.53 0.00e+00 4.517 0.001 302.00 328.00 3 2.3134e+00 2.7449e-03 5.3616e-02 -6.0000e+00 4.3475e-01 2.2751e-02 3.4761e-03 3.0964e-02 -6.0000e+00 4.6883e-01 -5.6211e-02 2.9570e-03 1.5339e-02 -6.0000e+00 2.8075e-01 1.2541e-02 1.4709e-03 4.2773e-03 -6.0000e+00 1.1666e-01 3.2805e-04 6.8495e-05 4.9775e-05 6.6829e-05 -6.0000e+00 9.8802e-03 2.7397e-02 -5.0791e-05 11 8 0 10 0 0 37.19 28.18 0.44 0.02740 0.02791 150 14 1 5 0 364.800 36.00 20.00 28.18 32.52 0.0 986.79 -65530 -54046 -44539 27302 -141939 -109555 -100303 -98984 -80889 -105531 25965 -54380 -47582 42117 -18691 -34119 -5714 41191 23175 -318 41069 -15812 57045 -5741 -6889 -35664 -23012 -17435 -24111 -10359 -4112 -9010 -14917 1110 -16281 37324 -9360 -1317 -8077 1992 -2237 418 6675 -5598 508 -5177 133 4574 1881 1940 4709 4012 2512 6391 -1380 1831 2420 624 213 -589 -707 1082 3942 525 -853 -562 3034 1832 63 1689 836 1382 -147 520 289 352 1171 -2098 -879 -540 -1344 -1198 -2776 -1251 399 -706 87 115 882 1052 -441 10 176 268 276 563 422 362 -81 -932 -478 -1074 -807 60 -202 -1415 -918 -259 35 438 285 101 31 251 -118 107 314 119 279 -35 -236 -242 895 919 90 199 16 329 737 -301 -69 -246 -302 -157 75 -12 -93 403 570 -155 -278 -201 -522 -387 -320 -251 75 -2108 -1220 -1117 -1225 -1028 -1899 141 -781 -784 350 -345 -857 -122 604 438 -8 714 -507 940 -192 -250 -1801 -1041 -751 -1152 -473 -202 -534 -1040 69 -1246 1767 -797 -123 -959 249 -325 64 1003 -979 85 -942 23 805 359 401 948 900 626 1654 -410 549 738 194 66 -186 -235 385 1504 225 -384 -254 1341 861 30 886 478 816 -87 292 151 169 584 -1019 -466 -328 -873 -874 -2255 -1076 335 -635 81 110 829 953 -383 9 153 240 253 585 467 446 -100 -1161 -602 -1266 -899 66 -234 -1755 -1129 -340 50 645 456 160 49 387 -185 163 478 187 433 -55 -379 -382 1428 1410 133 287 23 487 1185 -509 -120 -460 -598 -312 157 -26 -201 882 1237 -329 -592 -408 -1044 SS 20240720T125336.8Z 8967.537232 204 1 54.65 2 76.51 73.92 117.08 252.15 0.00 1 0.00 1 0 17 1.998e-01 6.697e-03 2.863e-02 1.119e-03 5.807017e-01 6.272259e-04 6.176123e-03 -6.000000e+00 1.279270e-01 230.04 -2.00 3.25 -2.00 319.93 0.00e+00 7.055889e-04 2.207584e-04 9.977587e-04 -6.000000e+00 6.003244e-03 293.20 -2.00 20.00 -2.00 319.11 0.00e+00 4.183 0.001 302.00 328.00 3 2.1068e+00 1.8837e-03 4.9754e-02 -6.0000e+00 3.1780e-01 1.0135e-02 2.3043e-03 2.8579e-02 -6.0000e+00 3.4271e-01 -4.0442e-02 1.8515e-03 1.3984e-02 -6.0000e+00 2.0522e-01 6.8714e-03 9.3877e-04 3.8741e-03 -6.0000e+00 8.5272e-02 5.7332e-04 -6.2757e-05 3.6494e-05 6.0199e-05 -6.0000e+00 7.2229e-03 2.7648e-02 -6.1981e-05 11 8 0 10 0 0 73.06 28.19 0.44 0.02765 0.02718 212 20 1 5 0 257.740 36.00 20.00 28.19 32.88 0.0 989.43 -14667 -69590 -54139 -46273 -95287 -89372 -78402 -74156 -67103 -75004 -14726 -32631 -33892 -5360 -20685 -19314 -7861 3869 8159 2613 11140 -7562 13914 -11659 -7532 -17074 -10648 -15470 -9847 -8533 -5573 -4119 -7592 -4133 -7999 12481 -7165 -1072 -2542 1944 -1911 -696 3297 -2625 645 -1834 -821 1985 205 1098 2754 2809 1066 4226 -65 1163 1563 885 716 493 830 823 3547 1429 109 -552 2106 957 244 1461 911 847 -236 234 -55 -339 323 -1605 -991 -1074 -1489 -1521 -2300 -1147 -413 -341 58 451 669 815 -32 275 -194 106 465 285 311 389 -6 -836 -610 -886 -853 39 -114 -1236 -705 -496 -42 473 214 -71 142 253 9 281 346 205 326 163 -220 -98 543 585 70 233 66 388 810 43 31 -125 -148 -289 -85 -50 -138 273 360 -251 -135 -139 -445 -94 -866 -603 -475 -1581 -1444 -1241 -1263 -1186 -1580 -190 -588 -751 -109 -589 -628 -256 122 265 95 385 -328 518 -604 -401 -1042 -617 -944 -585 -543 -390 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