File name: Pandora257s1_AustinTX_20250325_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250326T064615.7Z 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_20250325_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: 20250325 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 20250325T130814.7Z 9215.547392 115 1 55.37 2 82.21 92.18 61.00 143.73 0.00 1 0.00 1 0 25 5.945e-01 3.107e-02 2.847e-01 7.361e-03 8.126849e-01 4.702930e-03 9.182948e-03 -6.000000e+00 3.892330e-01 227.69 -2.00 3.25 -2.00 321.88 0.00e+00 1.829970e-02 2.867168e-03 4.495724e-03 -6.000000e+00 2.218877e-02 285.16 -2.00 20.00 -2.00 321.36 0.00e+00 6.872 0.004 302.00 328.00 3 2.1792e+00 1.8862e-02 7.8936e-02 -6.0000e+00 9.7154e-01 9.2251e-01 2.5299e-02 4.2418e-02 -6.0000e+00 1.0626e+00 -1.2167e+00 2.1957e-02 2.9051e-02 -6.0000e+00 6.2747e-01 4.8212e-01 9.9822e-03 1.8382e-02 -6.0000e+00 2.5735e-01 2.8873e-05 -2.4540e-04 2.4744e-04 3.9756e-04 -6.0000e+00 2.2377e-02 2.6946e-02 -8.9389e-05 12 8 8 10 0 0 97.33 27.33 0.44 0.02695 0.02510 40 4 1 5 0 1383.940 35.50 19.99 27.33 24.26 0.0 921.30 -19250 -83637 900000 900000 31417 -147657 -83448 64576 900000 118366 900000 -40932 900000 900000 900000 -2490 165946 900000 900000 900000 900000 122452 900000 900000 900000 -109916 -5580 900000 139973 900000 171157 80210 -32819 900000 2197 900000 -75089 33756 86625 133996 84955 900000 900000 -9332 18306 -7026 -22790 900000 61998 88056 81093 352016 41903 153274 -1276 23694 -2937 31120 25090 34401 39761 30101 128814 11304 -4525 9894 52473 36294 396 34177 19882 18702 -4157 3833 6901 11603 20308 -22888 4094 -239 -5665 4915 -7603 1365 11198 412 277 1461 1002 4854 -10580 -10017 -622 -4278 -1547 4798 139 -2151 -2256 -1233 -935 -3221 5028 -728 40 -5259 -4982 -992 -2601 2598 -1247 -1454 -1374 3017 426 -363 -210 -1637 -1085 -632 1499 -887 3105 6530 -859 742 2543 1249 3361 -80 -43 -1004 1732 1227 -1418 -847 -1128 791 1996 1256 -1219 -3058 -226 -288 -2554 900000 900000 245 -6236 -1735 462 900000 846 900000 -665 900000 900000 900000 -63 1186 900000 900000 900000 900000 955 900000 900000 900000 -7498 -131 900000 1000 900000 1223 1355 -1876 900000 88 900000 -6927 1279 2167 2298 2550 900000 900000 -800 1217 -618 -2427 900000 3146 3713 3999 2516 3564 4491 -180 2608 -416 3047 2546 3196 3694 3399 6076 1898 -938 1810 6413 5499 94 6326 4518 4371 -1182 937 1490 2198 3425 -6298 983 -71 -2065 1826 -3510 617 4858 210 146 776 530 2383 -5754 -5197 -294 -2238 -896 3055 109 -1773 -2008 -1096 -788 -2815 3773 -571 33 -4747 -4817 -918 -2732 2923 -1619 -2025 -1957 4074 575 -486 -285 -2344 -1613 -957 2199 -1290 4180 8193 -1122 933 3154 1671 4942 -137 -83 -1946 3503 2664 -3360 -2092 -2867 1991 4905 2984 -2800 -6753 -471 SS 20250325T132434.2Z 9215.558730 120 1 54.67 2 78.68 94.27 59.01 147.35 0.00 1 0.00 1 0 17 3.793e-01 8.402e-03 4.095e-02 1.270e-03 6.731166e-01 7.141911e-04 7.115258e-03 -6.000000e+00 2.407668e-01 227.70 -2.00 3.25 -2.00 320.42 0.00e+00 1.990072e-03 2.931271e-04 1.670156e-03 -6.000000e+00 1.102358e-02 285.16 -2.00 20.00 -2.00 319.77 0.00e+00 4.923 0.001 302.00 328.00 3 1.5606e+00 2.2256e-03 5.8296e-02 -6.0000e+00 5.9640e-01 8.5111e-02 2.8342e-03 3.3624e-02 -6.0000e+00 6.4518e-01 -1.1190e-01 2.5584e-03 1.7623e-02 -6.0000e+00 3.8514e-01 3.5626e-02 1.2589e-03 5.6759e-03 -6.0000e+00 1.5934e-01 4.4308e-04 -3.7215e-04 3.9686e-05 9.3072e-05 -6.0000e+00 1.3697e-02 2.6667e-02 -1.0837e-04 11 8 0 10 0 0 97.76 27.31 0.37 0.02667 0.02387 218 21 1 5 0 250.730 35.50 20.00 27.31 25.54 0.0 929.66 -122858 -119935 -100080 -119608 -173560 -162311 -138050 -93390 -98362 -129541 -71999 -95942 -75948 1230 -13851 -42996 -26335 43847 14261 7716 14097 -23711 22921 -2527 -9597 -34645 -24241 -23498 -25903 -12284 -5559 -15744 -14212 5565 -11105 16549 -15438 -4631 287 1888 -1647 4562 4659 -3079 -2734 -615 -2838 5988 -800 2045 2642 6537 3531 6181 1048 613 760 1026 552 1129 -19 1854 5688 1716 61 903 2515 2086 869 2314 996 1552 218 75 -327 99 -724 -2687 -1065 -1255 -1816 -1215 -2081 -1721 -308 -358 112 403 644 1082 49 -183 -502 -152 66 564 354 408 -298 -679 -689 -968 -368 -269 -295 -1477 -1109 -368 -83 412 354 67 86 -134 -75 174 485 306 376 221 -6 -76 745 838 195 400 -41 340 784 82 -231 -354 -231 -64 -91 -92 -112 392 365 -70 -302 -306 -372 -1010 -1080 -777 -1131 -2794 -2412 -1932 -937 -1157 -2310 -820 -1664 -1345 13 -202 -990 -584 532 251 153 272 -696 449 -69 -301 -1455 -934 -911 -1078 -496 -244 -887 -880 299 -725 865 -1250 -398 28 211 -213 600 643 -474 -429 -97 -473 956 -145 393 509 1345 822 1517 288 176 223 300 161 330 -6 619 2030 695 24 359 1003 882 409 1192 562 902 127 42 -168 47 -332 -1299 -564 -771 -1197 -899 -1584 -1404 -265 -326 106 362 613 990 43 -153 -415 -131 63 570 385 496 -366 -841 -864 -1128 -402 -292 -334 -1789 -1341 -477 -118 605 537 108 139 -212 -115 270 756 468 600 363 -9 -122 1139 1302 293 582 -59 514 1227 136 -422 -663 -459 -128 -193 -197 -246 868 804 -149 -641 -620 -738 SS 20250325T132959.7Z 9215.562496 123 1 54.73 2 77.51 94.97 58.39 148.60 0.00 1 0.00 1 0 17 2.595e-01 6.993e-03 2.200e-02 9.177e-04 6.215954e-01 5.103761e-04 6.573889e-03 -6.000000e+00 1.647080e-01 227.70 -2.00 3.25 -2.00 320.02 0.00e+00 2.048478e-03 1.834044e-04 1.228570e-03 -6.000000e+00 7.541411e-03 285.16 -2.00 20.00 -2.00 319.34 0.00e+00 4.496 0.001 302.00 328.00 3 1.4279e+00 1.5190e-03 5.3199e-02 -6.0000e+00 4.0799e-01 5.6280e-02 1.8583e-03 3.0315e-02 -6.0000e+00 4.4137e-01 -6.9267e-02 1.5840e-03 1.5683e-02 -6.0000e+00 2.6348e-01 1.7835e-02 7.9979e-04 5.1455e-03 -6.0000e+00 1.0901e-01 7.9246e-04 -3.0330e-04 2.9264e-05 7.8860e-05 -6.0000e+00 9.3700e-03 2.6669e-02 -1.1428e-04 11 8 0 10 0 0 99.46 27.31 0.34 0.02667 0.02439 333 32 1 5 0 164.330 35.50 20.00 27.31 25.59 0.0 929.83 -88655 -94999 -77887 -87604 -121339 -111001 -78579 -86399 -51154 -83839 -39988 -62968 -43319 -14294 -7486 -17809 -20528 8474 1305 -4729 2201 -16061 3810 -5108 -9468 -22151 -17370 -10994 -13977 -6213 -8284 -4738 -8452 -1289 -9419 6676 -9424 -3438 -2354 1444 -952 864 2541 -1670 162 707 -190 2529 417 887 2058 3786 2002 3557 475 1023 1118 859 892 849 780 2223 3490 1630 545 251 1224 1047 996 1473 777 902 -127 189 -33 -822 -641 -1847 -838 -1226 -1267 -1204 -2049 -1521 -527 -213 57 263 630 663 -172 172 -241 -84 267 483 250 365 28 -771 -542 -698 -650 -64 -194 -1268 -959 -445 -150 390 305 107 -43 79 -63 212 506 343 420 239 -89 51 517 746 213 300 67 334 772 -36 -109 -285 -245 -142 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