File name: Pandora257s1_AustinTX_20250418_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250419T063347.7Z 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_20250418_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: 20250418 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 20250418T132846.1Z 9239.561644 251 1 27.11 2 71.92 87.54 71.96 218.15 0.00 1 0.00 1 0 17 8.952e-02 1.112e-02 4.058e-02 3.831e-03 3.797648e-01 2.097362e-03 4.020938e-03 -6.000000e+00 5.729237e-02 229.45 -2.00 3.25 -2.00 319.10 0.00e+00 8.001966e-04 5.448294e-04 2.092460e-04 -6.000000e+00 2.619426e-03 286.82 -2.00 20.00 -2.00 318.32 0.00e+00 3.180 0.000 302.00 328.00 3 4.6611e+00 5.9012e-03 3.6002e-02 -6.0000e+00 1.4245e-01 -1.2165e-02 6.8583e-03 1.8358e-02 -6.0000e+00 1.5377e-01 2.2259e-02 4.8529e-03 9.0303e-03 -6.0000e+00 9.1766e-02 -1.8613e-02 2.4761e-03 2.8947e-03 -6.0000e+00 3.7965e-02 1.4421e-04 1.4443e-03 1.3669e-04 3.8402e-05 -6.0000e+00 3.2350e-03 2.2926e-02 1.7530e-04 12 9 9 12 1 1 100.00 27.82 0.50 0.02293 0.03378 26 5 1 5 0 1003.790 35.75 20.00 27.82 26.63 0.0 937.91 -7393 -4670 -7636 26390 -52886 -32260 3005 -15686 -16715 -19012 518 -10088 4055 24423 18132 -12822 2331 35365 23014 14408 16872 -8815 13416 4184 -49 -11138 -6676 8099 -4558 -2247 -2697 -416 -9219 1663 -9277 24834 -13170 -2748 -2762 4523 -1838 3298 5821 -3569 -920 -3528 -4203 2209 2334 1783 3305 5044 -674 5168 -2491 -1727 262 -351 -1774 178 179 909 5196 -519 -3026 -893 3004 1309 -854 1128 606 1558 -539 247 613 -703 2769 -4302 529 -1055 -2291 -1061 -3361 -1411 327 -25 108 272 1154 90 58 -104 937 318 747 1228 1077 834 -594 -599 -43 -1077 119 -282 270 -1784 -982 -101 54 1055 470 50 75 269 -19 -278 116 104 -43 -342 -271 -721 -248 1474 -210 471 56 648 859 -274 -736 -424 -68 -6 -70 -87 -228 719 898 37 -260 -780 -259 -178 -119 -225 542 -2331 -1169 82 -568 -668 -831 20 -479 192 1104 1002 -1078 183 2127 1651 1173 1380 -958 1218 441 -6 -1481 -848 871 -553 -276 -360 -59 -1539 257 -1612 3191 -2745 -601 -708 1232 -586 1063 1899 -1186 -300 -1189 -1426 777 833 667 1180 1905 -288 2208 -1199 -850 128 -174 -886 88 92 500 2950 -329 -1980 -557 1760 793 -566 804 468 1237 -400 190 439 -470 1676 -2771 345 -780 -1764 -892 -3127 -1375 334 -27 124 293 1329 101 61 -103 872 298 741 1338 1208 1026 -779 -783 -53 -1269 144 -321 322 -2295 -1324 -143 81 1562 739 81 119 405 -29 -409 170 158 -64 -531 -428 -1131 -378 2286 -316 677 79 924 1298 -417 -1198 -721 -120 -10 -128 -166 -449 1426 1779 72 -493 -1438 -468 SS 20250418T133749.5Z 9239.567934 257 1 54.67 2 69.97 88.66 73.15 219.73 0.00 1 0.00 1 0 17 2.693e-02 5.946e-03 5.235e-03 9.884e-04 3.552413e-01 5.419588e-04 3.838409e-03 -6.000000e+00 1.721025e-02 229.45 -2.00 3.25 -2.00 318.10 0.00e+00 1.349205e-04 1.034112e-04 1.916993e-04 -6.000000e+00 7.878758e-04 286.82 -2.00 20.00 -2.00 317.28 0.00e+00 2.888 0.000 302.00 328.00 3 3.3807e+00 1.4648e-03 3.2955e-02 -6.0000e+00 4.2788e-02 -1.2995e-02 1.6587e-03 1.7084e-02 -6.0000e+00 4.6210e-02 -2.6071e-03 1.0413e-03 8.2715e-03 -6.0000e+00 2.7574e-02 -4.0523e-03 5.1762e-04 2.2690e-03 -6.0000e+00 1.1394e-02 7.1129e-04 1.7464e-04 3.4789e-05 3.2684e-05 -6.0000e+00 9.7292e-04 2.5292e-02 -4.7949e-05 10 0 0 10 0 0 99.99 27.83 0.38 0.02529 0.02660 190 18 1 5 0 287.700 35.75 20.00 27.83 27.05 0.0 940.98 -7141 -4426 -5706 -2995 -16004 -13989 -8605 -1910 -5068 -8359 -2335 -7568 -3913 3001 851 -3254 -820 3035 1828 2788 3091 -969 2706 1523 -272 -2527 -2268 -967 -1929 513 -750 460 -1352 -963 -4484 2354 -3462 -787 -1254 165 -1238 -251 981 -1269 -117 -489 -739 444 -336 437 1113 1588 1120 1707 210 473 950 746 322 820 1015 1259 2351 687 -251 -572 602 371 495 1125 287 559 51 122 149 120 113 -1278 -293 -744 -1231 -1291 -2063 -1538 -840 -752 -273 101 454 204 -142 286 211 213 663 701 225 367 -91 -608 -499 -660 -362 16 -114 -1049 -797 -310 -102 352 282 49 -15 177 -86 128 435 283 265 215 -214 -197 180 628 259 678 177 597 1027 146 77 -133 -181 -4 48 -18 -211 289 204 -245 -334 -417 -511 -390 -253 -335 -166 -978 -844 -526 -120 -358 -648 -181 -678 -385 318 105 -461 -122 461 294 461 523 -175 491 295 -51 -499 -444 -201 -399 106 -153 101 -321 -233 -1133 576 -995 -256 -439 65 -541 -115 460 -618 -57 -238 -359 213 -164 220 591 830 628 1005 131 302 612 482 208 533 686 843 1671 520 -193 -427 433 270 385 889 247 497 46 104 119 94 83 -943 -227 -599 -1114 -1209 -2103 -1566 -907 -862 -308 116 520 239 -157 293 218 220 678 789 267 475 -118 -786 -650 -810 -426 19 -144 -1333 -1066 -437 -145 530 426 76 -22 267 -123 183 618 396 391 331 -321 -309 273 915 362 953 243 831 1503 219 117 -211 -299 -7 83 -32 -379 526 372 -440 -581 -734 -888 SS 20250418T135854.6Z 9239.582577 266 1 1.66 2 65.41 91.31 76.07 223.25 0.00 1 0.00 1 0 17 1.204e-02 6.283e-03 5.288e-03 2.184e-03 2.991791e-01 1.208489e-03 3.266047e-03 -6.000000e+00 7.693742e-03 229.45 -2.00 3.25 -2.00 316.75 0.00e+00 4.886864e-04 1.588914e-04 9.169991e-05 -6.000000e+00 3.522210e-04 286.82 -2.00 20.00 -2.00 315.95 0.00e+00 2.387 0.000 302.00 328.00 3 2.1087e+00 3.1683e-03 2.7322e-02 -6.0000e+00 1.9128e-02 -1.0970e-02 3.5414e-03 1.4233e-02 -6.0000e+00 2.0658e-02 -1.0758e-02 2.0414e-03 6.9035e-03 -6.0000e+00 1.2327e-02 8.4480e-04 9.3288e-04 1.9276e-03 -6.0000e+00 5.0936e-03 4.4104e-03 1.0781e-04 7.6830e-05 2.9111e-05 -6.0000e+00 4.3494e-04 2.5237e-02 -5.3102e-05 12 1 1 12 1 1 99.69 27.86 0.31 0.02524 0.02605 13 45 1 5 0 118.200 36.00 20.00 27.86 28.36 0.0 950.43 -360 -3404 -2307 -1958 -3638 -3076 -1719 181 -815 -5965 -3582 -2892 403 2075 298 -35 -1172 710 1875 1539 2124 -961 1482 1792 2477 -99 -664 -923 -1572 1112 243 741 590 -1185 -2625 -1194 -850 -913 190 -264 -963 -758 -420 -753 -462 -24 -61 -307 -171 -137 1486 925 353 1250 167 676 1030 904 452 1163 918 1615 1892 1362 190 -330 -108 -184 607 700 207 -340 266 277 -187 -83 396 -877 553 -761 -1461 -1583 -2090 -1746 -982 -731 -598 -21 541 130 6 242 -176 302 907 577 201 372 -22 -407 -732 -778 -626 210 -1 -911 -806 -121 -185 244 498 132 -4 101 -92 462 567 365 226 288 -2 -63 301 287 260 640 254 397 836 229 -3 -10 -143 211 -17 222 -278 162 219 -408 -339 -312 -774 -52 -534 -360 -293 -531 -445 -260 29 -144 -1065 -654 -567 86 493 74 -10 -346 216 545 463 648 -308 479 604 866 -36 -241 -326 -545 381 89 269 226 -469 -1055 -489 -358 -444 100 -149 -567 -470 -267 -487 -299 -16 -39 -194 -108 -89 946 631 245 900 126 496 762 669 335 865 712 1324 1578 1140 161 -281 -88 -151 526 634 194 -320 259 259 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