File name: Pandora257s1_AustinTX_20250527_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250528T063555.1Z 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_20250527_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: 20250527 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 20250527T125024.1Z 9278.535002 77 1 53.69 2 74.86 73.76 77.62 66.16 0.00 1 0.00 1 0 17 4.233e-01 2.341e-02 1.590e-01 5.341e-03 4.386619e-01 3.022451e-03 4.677177e-03 -6.000000e+00 2.741064e-01 230.94 -2.00 3.25 -2.00 320.00 0.00e+00 8.139496e-03 1.065986e-03 4.081975e-04 -6.000000e+00 1.379309e-02 289.85 -2.00 20.00 -2.00 319.21 0.00e+00 3.754 0.001 302.00 328.00 3 4.9806e+00 9.1813e-03 4.2601e-02 -6.0000e+00 6.8450e-01 6.6025e-02 1.1195e-02 2.2858e-02 -6.0000e+00 7.4000e-01 -3.8048e-02 8.8717e-03 1.3768e-02 -6.0000e+00 4.4161e-01 1.3983e-02 4.4462e-03 1.0150e-02 -6.0000e+00 1.8262e-01 5.3599e-05 9.2649e-04 1.9339e-04 1.1781e-04 -6.0000e+00 1.5510e-02 2.7365e-02 1.5946e-05 12 9 8 11 8 0 99.92 27.62 0.80 0.02737 0.03433 21 2 1 5 0 2556.240 35.75 20.00 27.62 26.03 0.0 931.83 -3122 -38763 900000 900000 -148817 -71563 -90167 -9711 167114 -14514 900000 -50504 77564 900000 900000 12963 27235 900000 114502 124735 900000 42637 234107 35336 38537 -16227 -18683 30229 -17357 356 11452 31120 -14272 37039 -12391 241699 -30108 -6783 -3518 8080 26640 13102 18214 -7827 -354 -5081 -12186 29485 7971 9194 9443 27051 430 16432 -2558 -6125 -6925 -1985 2863 317 -1703 1042 16595 -1218 -4654 -465 7418 3025 -1543 3916 -289 3002 -2473 251 630 3277 1469 -9198 -573 -1751 -4450 -484 -5875 -2424 881 -1607 -516 1175 1479 448 -3187 -2809 855 -745 617 3336 1576 196 -1940 -490 993 -1345 1314 1127 1476 -1799 -1049 1130 -555 2392 1296 213 -786 2058 546 -320 -854 -1453 -747 -1054 33 -1328 -1047 4081 -1655 346 1989 -295 1766 -571 -917 -1622 2011 1272 -1120 -210 -865 316 1316 1763 -603 -1996 -268 -38 -752 900000 900000 -8445 -1861 -2942 -152 869 -268 900000 -1648 844 900000 900000 441 978 900000 1966 2011 900000 1619 1340 1526 1664 -1232 -1458 1447 -1372 25 816 2040 -1596 2563 -1418 2263 -4714 -970 -566 1311 3936 2365 3269 -1881 -81 -1240 -3239 5261 1816 2176 2392 6206 138 4736 -925 -2348 -2702 -736 1011 117 -679 438 6509 -606 -2436 -229 3326 1452 -834 2198 -182 1888 -1629 154 357 1669 721 -5063 -313 -1091 -3218 -339 -4701 -2000 749 -1487 -494 1132 1413 417 -2895 -2381 670 -600 528 3104 1676 233 -2477 -614 1167 -1515 1380 1198 1643 -2188 -1341 1505 -806 3634 1934 329 -1209 3211 819 -466 -1252 -2221 -1192 -1609 50 -2212 -1690 6017 -2473 488 2702 -420 2636 -943 -1490 -2794 3485 2328 -2212 -431 -1837 675 2774 3606 -1216 -3930 -511 SS 20250527T131717.3Z 9278.553673 93 1 3.61 2 69.24 76.67 72.44 68.76 0.00 1 0.00 1 0 17 4.869e-02 8.650e-03 3.643e-02 6.200e-03 3.631674e-01 3.419605e-03 3.905572e-03 -6.000000e+00 3.128163e-02 230.94 -2.00 3.25 -2.00 318.20 0.00e+00 -2.149709e-04 6.779099e-04 1.080179e-04 -6.000000e+00 1.442656e-03 289.85 -2.00 20.00 -2.00 317.33 0.00e+00 2.793 0.000 302.00 328.00 3 3.9270e+00 9.3019e-03 3.2465e-02 -6.0000e+00 7.7975e-02 4.8977e-03 1.0565e-02 1.7559e-02 -6.0000e+00 8.4081e-02 7.2137e-03 6.6604e-03 8.4557e-03 -6.0000e+00 5.0204e-02 -5.1945e-03 3.3251e-03 2.2960e-03 -6.0000e+00 2.0746e-02 4.3671e-04 7.9537e-04 2.1791e-04 3.2602e-05 -6.0000e+00 1.7604e-03 2.6171e-02 -8.8894e-05 12 9 1 12 1 1 999.00 27.63 0.22 0.02617 0.03215 2 4 1 5 0 1197.480 35.75 19.99 27.63 27.39 0.0 941.87 8084 -22665 9548 17633 -17491 -16211 -7987 -4408 3100 -15937 -13421 9678 -5692 4335 13422 -3380 -1275 12549 15897 1280 949 -4176 5695 5416 -1092 -6879 -7288 1170 -5190 1967 -760 -1119 -2392 -281 -5399 3346 -3499 -3341 1101 -630 2998 -1026 1049 118 -2119 -1373 -2338 775 -1211 -1781 3347 2146 474 3039 965 809 1170 -82 -77 -850 -572 832 2269 629 -233 -197 627 1422 136 1814 -636 602 462 644 79 -999 281 -2603 366 -838 -964 -1377 -2370 -1734 -717 51 448 -159 -85 784 22 79 712 977 636 2201 -463 -345 -62 -886 -568 -953 376 99 629 -1256 365 -710 106 -535 653 501 -270 329 466 38 -434 -242 242 -274 -427 -76 1 495 -60 1090 462 396 305 -563 679 -56 352 1 -147 -264 -16 721 202 -447 -309 -630 -60 352 -1439 445 736 -1005 -931 -454 -266 189 -1253 -1095 690 -540 430 1380 -454 -180 1639 2105 204 155 -740 954 963 -218 -1354 -1430 226 -1057 384 -164 -239 -550 -65 -1318 780 -971 -1078 398 -241 1213 -458 473 55 -1007 -647 -1109 356 -576 -884 1678 1169 259 1706 576 497 727 -52 -48 -543 -380 582 1559 460 -172 -141 434 993 103 1479 -533 517 395 564 65 -762 214 -1875 272 -701 -843 -1332 -2342 -1816 -792 56 511 -187 -99 874 25 82 749 1024 666 2500 -564 -433 -82 -1160 -707 -1184 445 120 793 -1613 486 -1012 151 -817 984 769 -409 494 658 55 -623 -340 356 -424 -672 -118 2 715 -87 1515 631 549 449 -846 1068 -88 573 1 -251 -474 -29 1282 360 -823 -549 -1085 -102 SS 20250527T132612.2Z 9278.559863 96 1 36.17 2 67.36 77.62 70.70 69.58 0.00 1 0.00 1 0 25 1.514e-02 5.776e-03 1.250e-03 4.073e-04 3.410726e-01 2.262386e-04 3.699390e-03 -6.000000e+00 9.729408e-03 230.94 -2.00 3.25 -2.00 317.19 0.00e+00 4.494049e-04 3.344347e-05 1.281673e-04 -6.000000e+00 4.486856e-04 289.85 -2.00 20.00 -2.00 316.33 0.00e+00 2.577 0.000 302.00 328.00 3 1.6420e+00 5.9916e-04 3.0060e-02 -6.0000e+00 2.4252e-02 -5.7484e-04 6.7132e-04 1.6343e-02 -6.0000e+00 2.6152e-02 -6.7800e-03 3.9259e-04 7.8961e-03 -6.0000e+00 1.5615e-02 6.0796e-04 1.8472e-04 2.1794e-03 -6.0000e+00 6.4525e-03 5.4553e-03 1.4715e-04 1.4219e-05 3.2143e-05 -6.0000e+00 5.4753e-04 2.7096e-02 -5.1621e-05 12 1 1 12 1 1 99.90 27.64 0.30 0.02710 0.02820 412 60 1 5 0 87.570 35.75 19.99 27.64 28.20 0.0 948.39 -3514 -4709 -4167 -5703 -7346 -5353 -4254 -2979 -3220 -4290 -4407 -2473 -793 -121 419 -40 -191 1004 971 1353 1430 480 1287 1304 493 -212 -459 -958 -272 878 824 537 324 -1009 -2622 -963 -947 -255 -130 -93 -792 -609 -160 -250 -47 -84 -421 -77 -191 362 1083 1094 914 1278 562 822 911 533 470 814 1168 1523 1404 1284 51 -437 45 98 712 917 191 24 -73 110 -116 -365 -249 -729 -323 -555 -1284 -1518 -1927 -1704 -1016 -777 -332 -193 208 239 182 284 71 296 663 475 225 364 72 -572 -543 -566 -591 41 -104 -935 -725 -382 -177 307 395 205 108 120 -24 209 413 310 355 289 -77 -50 357 369 423 623 301 778 966 285 90 -98 -238 -55 137 -9 -218 161 111 -386 -308 -413 -657 -357 -519 -461 -621 -783 -562 -470 -356 -418 -596 -648 -390 -139 -22 87 -9 -47 238 241 346 374 130 358 382 152 -63 -145 -296 -82 269 250 177 113 -365 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