File name: Pandora257s1_AustinTX_20251005_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20251006T062628.8Z 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_20251005_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: 20251005 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 20251005T125645.4Z 9409.539415 192 1 55.04 2 84.47 99.02 118.25 282.71 0.00 1 0.00 1 0 25 6.958e-01 6.828e-02 2.205e-01 1.591e-02 7.918120e-01 1.073513e-02 1.307717e-02 -6.000000e+00 4.779319e-01 227.39 -2.00 3.25 -2.00 322.21 0.00e+00 -4.234168e-02 5.354374e-03 9.782352e-03 -6.000000e+00 3.193107e-02 290.82 -2.00 20.00 -2.00 321.59 0.00e+00 9.094 0.009 302.00 328.00 3 1.4219e+00 4.2489e-02 9.8375e-02 -6.0000e+00 1.2147e+00 1.3498e+00 5.7696e-02 4.6247e-02 -6.0000e+00 1.3464e+00 -2.1110e+00 4.0141e-02 6.2103e-02 -6.0000e+00 7.6993e-01 8.4849e-01 1.7863e-02 4.0541e-02 -6.0000e+00 3.1939e-01 1.0261e-05 1.8720e-03 6.2438e-04 7.4375e-04 -6.0000e+00 2.8138e-02 3.0159e-02 2.1717e-05 12 8 8 10 0 0 18.76 27.66 1.18 0.03016 0.04423 33 3 1 5 0 1667.760 35.75 19.99 27.66 28.19 0.0 943.83 900000 227241 900000 900000 60196 176939 900000 900000 900000 900000 900000 224189 258237 900000 900000 135022 900000 900000 900000 900000 900000 900000 900000 900000 900000 -46667 180414 900000 43234 900000 900000 900000 71053 900000 76250 900000 -39210 198510 900000 900000 900000 900000 900000 50908 61104 55276 17704 900000 900000 900000 900000 900000 77346 900000 37688 82785 50908 155966 114768 96141 6702 40278 900000 21997 -42212 19130 900000 183969 31168 79894 44267 87581 14148 64053 84368 80287 80929 -43551 15566 10575 -20617 14443 -20279 10683 53588 5723 10572 17196 22296 10489 -31485 -7972 20063 12240 7181 24822 9743 -6144 -13447 -7280 2792 -11685 10983 -2417 9326 -5834 -6718 359 1481 9453 -2665 -2834 -1854 8226 4897 1850 -1228 -5926 -4802 -6066 -102 -5828 3677 21268 -6073 3413 5396 3108 4926 -2325 -694 -3208 5607 2556 -3890 -1957 -377 1759 4644 5220 -2390 -5768 -134 900000 5531 900000 900000 4858 4533 900000 900000 900000 900000 900000 5639 4331 900000 900000 6416 900000 900000 900000 900000 900000 900000 900000 900000 900000 -13435 4790 900000 3202 900000 900000 900000 3376 900000 3197 900000 -5973 3329 900000 900000 900000 900000 900000 4411 4270 3708 1608 900000 900000 900000 900000 900000 5469 900000 4577 6745 5791 5994 6175 5764 948 4148 900000 2976 -10966 2676 900000 5373 4648 8106 6873 9020 2958 7582 7393 6665 6345 -12118 2632 2146 -6560 3663 -8043 3366 11780 2147 3917 6027 7300 3709 -16117 -3125 6014 4253 2948 9768 5078 -4175 -10439 -5327 1768 -8029 5774 -1475 5347 -4153 -5184 282 1282 8501 -3003 -3428 -2286 9130 5502 2116 -1469 -7726 -6473 -8513 -134 -7964 4454 21055 -7711 3883 6088 3837 6686 -3828 -1249 -6450 11128 5636 -8910 -4635 -906 4188 10610 11372 -5311 -13858 -300 SS 20251005T130745.9Z 9409.547059 195 1 54.58 2 82.13 100.46 120.44 284.39 0.00 1 0.00 1 0 25 4.705e-01 1.360e-02 1.765e-01 2.430e-03 7.312618e-01 1.453636e-03 7.709694e-03 -6.000000e+00 3.025096e-01 227.39 -2.00 3.25 -2.00 321.29 0.00e+00 -5.808540e-04 8.060584e-04 3.053623e-03 -6.000000e+00 1.539053e-02 290.81 -2.00 20.00 -2.00 320.65 0.00e+00 6.809 0.004 302.00 328.00 3 9.1908e-01 5.3925e-03 7.6731e-02 -6.0000e+00 7.5431e-01 1.5099e-01 7.6538e-03 4.2364e-02 -6.0000e+00 8.2211e-01 -2.5008e-01 7.2334e-03 2.0011e-02 -6.0000e+00 4.8735e-01 9.5883e-02 3.3145e-03 5.3491e-03 -6.0000e+00 2.0051e-01 1.4978e-04 -4.4775e-04 7.9248e-05 9.5581e-05 -6.0000e+00 1.7111e-02 3.2196e-02 -9.7911e-05 12 8 8 10 0 0 11.81 27.66 0.43 0.03220 0.02883 165 16 1 5 0 330.740 35.75 20.00 27.66 28.74 0.0 947.95 93263 -125875 68062 -105741 -246435 -221463 -155666 -91242 900000 -178241 900000 -78582 -91061 900000 900000 -90438 -20169 900000 900000 900000 900000 -37355 900000 67790 2454 -146269 -45379 7893 -39444 1770 15803 10905 -14705 28764 -9951 900000 -36831 4425 4300 25549 43585 14223 34349 -11151 1505 -12076 -9436 34521 3083 14642 11622 21638 7469 22862 1470 2542 4839 4070 1372 1561 -3050 2153 14854 457 -1908 -842 7570 6286 321 4916 3571 4434 -503 1615 2503 1763 2679 -5228 -1908 -632 -4331 -1474 -2351 -1232 1590 502 472 998 1330 1404 -2438 -266 -1519 -596 -168 1232 448 -94 -913 -1849 -974 -1811 18 -523 -474 -2540 -1207 72 -245 692 343 36 -68 887 -12 14 360 -25 31 -273 198 185 799 1517 205 64 350 573 830 -296 -61 -269 38 -11 -390 -46 -114 575 531 -40 -146 -615 -530 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290.81 -2.00 20.00 -2.00 318.99 0.00e+00 4.934 0.001 302.00 328.00 3 5.8339e-01 1.1274e-03 5.5126e-02 -6.0000e+00 3.0625e-01 3.0302e-02 1.3632e-03 2.7493e-02 -6.0000e+00 3.3110e-01 -5.5645e-02 1.0748e-03 1.3703e-02 -6.0000e+00 1.9841e-01 1.5505e-02 5.4714e-04 4.1014e-03 -6.0000e+00 8.2590e-02 1.3642e-03 -1.6208e-04 2.2637e-05 6.3306e-05 -6.0000e+00 7.0651e-03 3.1472e-02 -8.6345e-05 11 8 0 10 0 0 14.69 27.62 0.34 0.03147 0.03025 597 58 1 5 0 91.620 35.50 20.00 27.62 29.80 0.0 955.61 -66848 -61241 -59688 -66763 -86613 -78362 -75892 -54040 -51982 -53151 -42963 -40898 -41338 -21307 -16502 -14747 -15256 -4094 -4958 -8786 -2815 -10263 2499 -9126 -9022 -22075 -12324 -9665 -9368 -5897 -4763 -5477 -5780 -4509 -7011 1739 -4843 -3091 -1917 765 988 790 1982 -203 1063 283 1006 1408 -172 498 2396 3066 2137 2883 1559 1560 790 925 1049 850 1378 2042 2958 1987 677 136 1265 900 1014 1558 796 741 154 50 -149 -759 -605 -1240 -1048 -916 -1868 -1631 -2119 -1585 -865 -582 -82 197 553 547 62 269 42 147 249 274 59 328 -31 -518 -510 -865 -652 -136 -387 -1364 -738 -361 -149 394 388 201 53 159 59 207 410 278 233 78 -143 -111 496 473 373 443 134 697 824 94 50 -174 -242 -76 -8 -52 -169 260 229 -311 -244 -232 -388 -882 -849 -848 -1011 -1580 -1356 -1395 -891 -931 -1056 -859 -936 -1155 -597 -527 -534 -621 -163 -213 -412 -129 -526 119 -527 -555 -1605 -822 -630 -627 -415 -376 -495 -577 -465 -759 182 -609 -450 -298 134 191 165 428 -46 243 67 240 345 -45 139 718 921 705 1015 587 611 318 373 420 345 585 939 1367 999 356 72 665 497 567 959 533 515 107 33 -91 -433 -355 -750 -646 -645 -1419 -1300 -1854 -1394 -807 -574 -84 195 574 548 59 242 39 133 247 291 67 395 -39 -665 -624 -1042 -746 -156 -465 -1668 -954 -476 -213 584 593 320 85 244 91 308 613 430 363 126 -231 -176 760 730 554 635 200 1024 1314 158 88 -313 -442 -147 -16 -104 -347 539 472 -625 -486 -461 -760 SS 20251005T132921.2Z 9409.562050 203 1 54.71 2 77.57 103.36 124.68 287.90 0.00 1 0.00 1 0 17 1.308e-01 6.542e-03 7.399e-03 5.290e-04 5.220745e-01 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