File name: Pandora257s1_AustinTX_20250104_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250105T064226.4Z 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 v1.8.60 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20250104_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: 20250104 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 20250104T214809.3Z 9135.908441 356 1 2.02 2 70.10 226.82 39.52 155.71 0.00 1 0.00 1 0 17 3.825e-02 8.039e-03 2.685e-02 6.044e-03 3.459974e-01 3.260863e-03 3.793130e-03 -6.000000e+00 2.400188e-02 224.21 -2.00 3.25 -2.00 317.79 0.00e+00 -1.531064e-04 5.785987e-04 9.795525e-05 -6.000000e+00 1.106343e-03 283.97 -2.00 20.00 -2.00 317.04 0.00e+00 2.906 0.000 302.00 328.00 3 3.3701e+00 8.6526e-03 3.2546e-02 -6.0000e+00 5.9004e-02 9.8523e-03 9.7978e-03 1.6257e-02 -6.0000e+00 6.3969e-02 1.4019e-02 6.0836e-03 7.9939e-03 -6.0000e+00 3.8265e-02 -1.0129e-02 3.0175e-03 2.2522e-03 -6.0000e+00 1.5944e-02 7.1025e-04 4.3734e-04 2.1149e-04 3.3552e-05 -6.0000e+00 1.3798e-03 2.0087e-02 -1.6832e-05 12 9 1 12 1 1 999.00 27.87 0.49 0.02009 0.02337 2 8 1 5 0 671.540 36.00 20.00 27.87 27.39 0.0 943.54 920 -6067 -14844 -7514 -22011 -3696 -10430 -19903 897 -3278 -6755 4073 8039 13676 9048 2364 4703 2685 3501 6471 -1464 -4937 852 -1830 598 1232 -3226 975 -4670 1064 1896 1051 1616 2165 1118 1631 -4057 -674 417 -1781 -1215 -1622 1137 134 -796 -677 -1065 956 -1507 -266 -1845 897 1961 894 906 1166 -67 426 -1286 1482 981 1702 1522 529 -281 -2016 943 334 -401 1453 -686 236 426 651 81 -750 597 -1311 530 -255 -1151 -565 -1723 -1368 8 -1566 -780 914 468 431 465 -269 1106 68 215 1485 839 781 -88 -366 -1057 -1061 28 367 -81 -1073 -850 -425 -145 44 324 -28 32 351 256 323 12 792 47 -178 -1148 -131 418 702 217 152 898 -425 1838 -193 30 -352 -373 -273 100 -87 -20 207 127 -248 -222 380 -650 57 -433 -1172 -536 -1751 -246 -793 -1830 73 -296 -669 396 853 1580 1243 383 728 449 608 1130 -284 -1016 172 -401 135 282 -769 217 -1084 238 449 272 442 604 317 476 -1269 -236 169 -778 -578 -822 579 70 -422 -359 -563 494 -806 -145 -1007 511 1177 572 604 797 -44 278 -849 960 664 1220 1173 405 -218 -1540 724 261 -315 1225 -599 212 381 558 69 -594 465 -1025 429 -217 -1036 -557 -1753 -1480 8 -1820 -894 1056 541 507 513 -294 1129 70 233 1649 988 1005 -115 -475 -1382 -1305 35 432 -101 -1359 -1134 -596 -206 64 490 -43 48 526 361 455 17 1087 69 -271 -1725 -194 627 1010 314 211 1202 -583 2604 -285 45 -552 -605 -442 170 -149 -35 371 228 -439 -379 650 -1106 SS 20250104T215143.7Z 9135.910922 359 1 0.76 2 70.66 227.46 39.20 156.98 0.00 1 0.00 1 0 25 2.880e-02 7.952e-03 2.203e-02 5.899e-03 3.614296e-01 3.194218e-03 3.964886e-03 -6.000000e+00 1.806710e-02 224.21 -2.00 3.25 -2.00 317.57 0.00e+00 -9.892411e-04 5.270282e-04 2.313610e-04 -6.000000e+00 8.328626e-04 283.97 -2.00 20.00 -2.00 316.82 0.00e+00 2.985 0.000 302.00 328.00 3 2.3415e+00 8.4233e-03 3.3565e-02 -6.0000e+00 4.4414e-02 2.0367e-02 9.5038e-03 1.6994e-02 -6.0000e+00 4.8153e-02 -1.8808e-02 5.7474e-03 8.3258e-03 -6.0000e+00 2.8804e-02 3.4402e-03 2.7976e-03 2.4313e-03 -6.0000e+00 1.2001e-02 1.8204e-03 4.2779e-04 2.0515e-04 3.5903e-05 -6.0000e+00 1.0387e-03 1.9849e-02 -4.5810e-05 12 9 1 12 1 1 999.00 27.87 0.26 0.01985 0.02306 2 21 1 5 0 252.420 35.75 20.00 27.87 27.44 0.0 944.44 -10149 -9041 -7846 -3023 -11217 -1670 2345 1059 -9764 -18081 7194 -2181 -7778 1526 -2184 -745 839 -4463 727 3749 3026 -190 -2632 2724 888 -3536 964 3497 1328 1209 1819 1407 -2557 -1094 -2320 825 -2294 -1063 -1472 -63 -432 868 -426 -545 1236 -1029 187 965 928 1306 1015 1542 602 837 891 983 -96 718 -239 1970 2258 2352 801 1826 424 -710 -1243 665 -185 1521 297 -545 224 -986 -1019 663 24 -1304 299 -1357 -882 -939 -2697 -1740 -972 -80 -512 -640 420 -272 -319 -263 -394 598 1580 673 -267 -143 504 -322 -712 -187 685 -642 -202 -868 -1028 -93 -455 912 -334 56 689 -94 237 414 -261 853 322 -304 260 588 404 -143 203 1103 571 376 1033 152 71 -184 -273 149 -325 551 -606 366 197 -785 -468 -248 -431 -876 -827 -718 -256 -994 -135 196 99 -1107 -2156 778 -258 -1102 227 -381 -141 168 -916 148 767 640 -43 -630 654 229 -978 253 872 332 310 494 415 -772 -333 -720 257 -815 -402 -655 -29 -223 438 -225 -292 653 -555 99 506 493 715 592 903 379 556 583 662 -67 492 -164 1334 1582 1758 618 1463 346 -570 -975 518 -148 1304 265 -508 206 -884 -895 554 19 -1025 244 -1190 -820 -920 -2782 -1818 -1074 -89 -602 -741 498 -313 -360 -277 -411 616 1705 773 -317 -178 657 -422 -894 -228 827 -763 -251 -1108 -1388 -127 -639 1304 -509 83 1043 -137 334 577 -364 1212 468 -448 389 869 604 -206 289 1496 786 507 1462 224 107 -284 -436 241 -538 946 -1053 641 347 -1364 -806 -412 -729 SS 20250104T215529.7Z 9135.913538 362 1 54.71 2 71.27 228.12 38.88 158.35 0.00 1 0.00 1 0 17 2.324e-02 5.702e-03 2.035e-03 4.441e-04 3.658790e-01 2.400263e-04 4.003732e-03 -6.000000e+00 1.457970e-02 224.21 -2.00 3.25 -2.00 317.86 0.00e+00 7.158233e-04 4.303791e-05 1.978595e-04 -6.000000e+00 6.720992e-04 283.97 -2.00 20.00 -2.00 317.10 0.00e+00 3.075 0.000 302.00 328.00 3 1.7162e+00 6.3777e-04 3.4425e-02 -6.0000e+00 3.5841e-02 1.4545e-02 7.2175e-04 1.7170e-02 -6.0000e+00 3.8858e-02 -1.0836e-02 4.4919e-04 8.4838e-03 -6.0000e+00 2.3244e-02 -5.6783e-04 2.2336e-04 2.4902e-03 -6.0000e+00 9.6844e-03 3.0956e-03 1.1906e-04 1.5471e-05 3.6154e-05 -6.0000e+00 8.3821e-04 2.1015e-02 -8.2488e-06 10 0 0 10 0 0 100.00 27.88 0.32 0.02101 0.02191 1013 98 1 5 0 54.000 35.75 20.00 27.88 27.63 0.0 946.22 -5899 -7176 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