File name: Pandora257s1_AustinTX_20250530_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250531T063313.9Z 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 v1.8.75 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20250530_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: 20250530 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 20250530T154854.2Z 9281.658961 191 1 53.99 2 36.65 93.49 80.79 67.12 0.00 1 0.00 1 0 17 1.369e-02 8.159e-03 2.805e-03 1.708e-03 1.594672e-01 9.550399e-04 1.767030e-03 -6.000000e+00 8.795263e-03 230.95 -2.00 3.25 -2.00 315.53 0.00e+00 2.804609e-04 9.655950e-05 3.930760e-05 -6.000000e+00 4.060599e-04 290.11 -2.00 20.00 -2.00 314.76 0.00e+00 1.245 0.000 302.00 328.00 3 6.1060e+00 2.4739e-03 1.4401e-02 -6.0000e+00 2.1922e-02 -5.7651e-03 2.7430e-03 7.6856e-03 -6.0000e+00 2.3638e-02 2.2892e-02 1.5663e-03 3.7088e-03 -6.0000e+00 1.4116e-02 -1.1893e-02 6.7500e-04 1.0431e-03 -6.0000e+00 5.8346e-03 3.0330e-04 5.0622e-04 6.0949e-05 1.7471e-05 -6.0000e+00 4.9498e-04 2.7308e-02 -5.5443e-05 11 9 0 11 32 0 99.99 28.01 1.08 0.02731 0.03111 28 3 1 5 0 1927.760 36.00 19.99 28.01 30.48 0.0 964.75 -2757 -2915 -1782 837 -5658 -3087 -3100 -1400 903 -58 -168 -2213 1342 3474 2674 -1241 -2 3041 2207 2014 4093 30 2950 73 972 -416 -1496 668 48 2025 1760 1003 -588 -5 -3726 -3144 -2934 -645 188 -581 -193 -921 17 -1017 -523 -1106 -2422 522 -109 132 1237 2139 200 1784 31 374 54 333 384 834 679 1118 2570 537 -1291 -668 652 -158 404 1208 291 244 -327 -36 41 444 324 -2067 -637 -779 -1741 -1296 -2472 -1481 -85 -678 -141 482 617 477 -253 -255 450 248 680 1059 804 596 -92 -277 -244 -837 -149 42 118 -808 -685 -38 35 772 264 244 70 641 -365 -358 -79 -68 38 -135 -136 -371 -4 1031 77 458 276 205 958 -135 -185 -516 -8 358 26 82 -286 263 619 243 -667 -971 -165 -780 -854 -508 220 -1497 -783 -822 -393 263 -18 -52 -726 458 1271 971 -495 -1 1237 927 865 1743 14 1308 34 467 -204 -724 302 21 847 752 448 -274 -2 -1766 -1518 -1545 -380 126 -402 -143 -720 14 -816 -415 -871 -1881 382 -79 95 910 1632 162 1476 27 326 47 292 336 734 620 989 2353 512 -1224 -642 583 -140 374 1109 288 251 -338 -36 38 408 275 -1727 -539 -713 -1626 -1306 -2690 -1691 -94 -807 -176 609 776 578 -288 -287 467 250 703 1172 970 719 -116 -345 -290 -1024 -177 51 140 -1026 -911 -52 50 1072 378 348 96 876 -467 -434 -95 -84 50 -188 -195 -534 -6 1375 99 599 349 259 1235 -171 -243 -699 -11 508 39 120 -431 403 949 369 -997 -1421 -254 SS 20250530T155734.8Z 9281.664986 197 1 54.91 2 34.78 94.77 79.12 68.05 0.00 1 0.00 1 0 17 9.233e-03 6.814e-03 1.550e-03 1.061e-03 1.581210e-01 5.990227e-04 1.735680e-03 -6.000000e+00 5.932530e-03 230.95 -2.00 3.25 -2.00 315.00 0.00e+00 1.383944e-04 5.438860e-05 2.423250e-05 -6.000000e+00 2.738613e-04 290.11 -2.00 20.00 -2.00 314.29 0.00e+00 1.217 0.000 302.00 328.00 3 5.4042e+00 1.5413e-03 1.4095e-02 -6.0000e+00 1.4787e-02 -2.1156e-03 1.7042e-03 7.5281e-03 -6.0000e+00 1.5944e-02 1.1593e-02 9.7167e-04 3.6392e-03 -6.0000e+00 9.5213e-03 -7.3833e-03 4.1208e-04 9.9570e-04 -6.0000e+00 3.9358e-03 6.3303e-04 3.7264e-04 3.7895e-05 1.7086e-05 -6.0000e+00 3.3384e-04 2.6965e-02 -4.2927e-05 11 9 0 11 32 0 99.88 28.02 0.43 0.02697 0.02977 30 3 1 5 0 1830.230 36.00 20.00 28.02 31.04 0.0 969.29 -1363 -1722 -1616 -92 -3451 -817 -560 -206 572 -635 -763 -1041 -670 1357 1223 -1092 -220 1434 1009 1543 2611 28 2344 1035 1135 -201 -738 169 -420 1266 1662 814 -312 -560 -3075 821 -1653 -796 -156 -866 -682 -1014 -122 -686 -937 -718 -1734 -1207 -269 179 855 1517 548 1308 527 472 404 249 498 956 1303 1494 1744 454 -590 -765 92 198 711 1080 239 382 -117 117 38 234 15 -1347 -342 -352 -1547 -1267 -2012 -1518 -756 -664 -176 -7 215 291 -16 -12 132 271 536 841 402 512 -217 -508 -213 -584 -403 214 -15 -771 -698 -277 -175 503 451 117 70 260 -192 70 161 261 120 141 75 -350 189 736 265 641 516 670 893 141 101 -552 -222 15 84 -58 -249 300 477 -16 -499 -768 -564 -458 -600 -553 -29 -1071 -243 -173 -68 200 -231 -282 -402 -254 551 538 -519 -107 705 510 790 1339 15 1239 529 596 -107 -388 91 -216 629 836 428 -170 -306 -1699 446 -929 -506 -105 -658 -520 -809 -99 -560 -762 -573 -1361 -979 -211 140 687 1264 449 1102 458 417 360 221 440 850 1195 1351 1651 445 -570 -697 83 177 662 1016 242 401 -123 119 36 218 13 -1125 -290 -323 -1473 -1304 -2226 -1668 -877 -773 -214 -9 266 346 -19 -13 140 279 567 951 468 605 -267 -621 -262 -685 -460 249 -19 -956 -907 -374 -234 694 640 165 96 349 -240 87 199 333 154 191 99 -466 258 963 331 805 625 807 1108 184 129 -730 -299 21 116 -83 -371 456 728 -24 -739 -1114 -807 SS 20250530T160231.2Z 9281.668417 200 1 4.08 2 33.72 95.53 78.17 68.58 0.00 1 0.00 1 0 17 1.344e-02 8.654e-03 7.942e-03 5.480e-03 1.570244e-01 3.089583e-03 1.700632e-03 -6.000000e+00 8.639249e-03 230.95 -2.00 3.25 -2.00 314.94 0.00e+00 4.080125e-04 2.785048e-04 2.095356e-05 -6.000000e+00 3.987374e-04 290.11 -2.00 20.00 -2.00 314.25 0.00e+00 1.201 0.000 302.00 328.00 3 5.4106e+00 7.9460e-03 1.3919e-02 -6.0000e+00 2.1534e-02 4.4667e-03 8.7829e-03 7.4456e-03 -6.0000e+00 2.3217e-02 9.0623e-03 5.0099e-03 3.5833e-03 -6.0000e+00 1.3865e-02 -6.0130e-03 2.1256e-03 1.0173e-03 -6.0000e+00 5.7326e-03 6.3778e-04 6.8284e-04 1.9507e-04 1.6726e-05 -6.0000e+00 4.8606e-04 2.5365e-02 -5.4894e-05 12 9 1 12 33 1 999.00 28.04 0.53 0.02536 0.03050 1 3 1 5 0 2036.010 36.00 19.99 28.04 31.30 0.0 971.15 535 -5253 -6305 513 -3833 413 480 1869 -1679 655 303 -3606 -277 -557 2848 -178 1292 2529 2224 4028 2291 67 2193 -68 901 -1490 899 -239 -1945 1398 642 -262 -1126 -1671 -3283 487 -415 652 1113 -281 122 -727 -161 -1446 -1188 -1095 -2939 -36 -46 292 795 2060 387 1209 -83 -171 -256 1324 1115 1460 1167 1210 2186 128 -106 -1412 166 -666 599 397 524 188 -456 282 173 -1138 -20 -631 -399 -211 -1829 -1257 -1042 -2294 -318 109 -1371 179 676 273 -242 -321 -938 1069 1109 346 25 783 182 784 32 -856 -565 -175 449 -934 -809 -14 308 990 451 346 -425 814 281 42 -181 -148 -448 -2 -290 200 63 1249 646 176 484 683 -221 -252 -366 -310 85 -371 -592 210 -156 -423 786 308 -26 -396 -605 182 -1792 -2134 167 -1229 125 151 622 -613 240 113 -1338 -107 -236 1261 -86 635 1258 1135 2058 1204 33 1093 -36 482 -820 471 -131 -1034 705 332 -141 -630 -938 -1846 270 -234 415 751 -215 94 -585 -132 -1202 -980 -889 -2363 -29 -36 232 646 1612 321 1030 -74 -153 -231 1173 987 1302 1082 1108 2080 127 -103 -1305 152 -605 562 379 534 199 -487 288 165 -1079 -17 -526 -341 -194 -1757 -1300 -1148 -2551 -370 126 -1692 223 834 325 -286 -349 -1013 1095 1169 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