File name: Pandora257s1_AustinTX_20240902_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240903T063619.6Z 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 v1.8.59 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20240902_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: 20240902 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 20240902T143639.1Z 9011.608786 121 1 3.35 2 59.05 99.87 54.28 97.48 0.00 1 0.00 1 0 17 1.651e-02 7.734e-03 9.547e-03 4.536e-03 2.450702e-01 2.515144e-03 2.709039e-03 -6.000000e+00 1.052339e-02 228.90 -2.00 3.25 -2.00 316.26 0.00e+00 1.027219e-04 3.041070e-04 4.728360e-05 -6.000000e+00 4.951763e-04 292.83 -2.00 20.00 -2.00 315.40 0.00e+00 1.937 0.000 302.00 328.00 3 4.3104e+00 6.5372e-03 2.2205e-02 -6.0000e+00 2.6073e-02 3.1555e-02 7.2971e-03 1.1698e-02 -6.0000e+00 2.8143e-02 5.6786e-03 4.1772e-03 5.6805e-03 -6.0000e+00 1.6865e-02 -6.7328e-03 1.8857e-03 1.5678e-03 -6.0000e+00 7.0199e-03 7.9952e-04 3.4125e-04 1.6055e-04 2.5137e-05 -6.0000e+00 5.9646e-04 2.7691e-02 -7.8441e-05 12 9 1 12 1 1 999.00 28.37 0.21 0.02769 0.03026 2 5 1 5 0 1114.510 36.25 20.00 28.37 32.43 0.0 983.24 -871 -6131 -2642 1008 -6398 -6290 -2740 -4702 -3206 4097 -2860 938 -606 -508 1792 -207 339 2875 3382 2556 4256 343 5252 -229 1016 -1271 -1558 1407 -754 537 1660 204 1577 -757 -4960 362 -1899 -1073 -464 255 -981 -314 -447 -1342 -1029 -648 -670 -1287 -1051 1033 1482 1301 110 534 702 247 2320 123 1502 502 -131 1347 1513 41 -178 -834 -68 399 501 739 530 386 207 390 400 -582 -361 -2127 -379 -699 -1015 -1426 -1624 -2117 -682 -248 306 -2 -160 471 284 262 155 714 529 1283 638 657 218 -152 -407 -525 -1049 -178 -163 -631 -463 -46 -387 92 728 -172 345 -148 -130 127 -84 -306 536 -246 -306 -674 860 1326 -205 336 -156 677 1120 865 84 -343 -208 -100 229 -473 -129 -7 -146 155 -250 -415 -205 -152 -1181 -489 172 -1119 -1093 -485 -921 -663 820 -636 214 -155 -145 552 -64 110 945 1143 894 1489 127 1899 -91 415 -537 -649 547 -290 204 648 85 679 -336 -2287 163 -888 -573 -265 162 -639 -214 -312 -953 -728 -452 -459 -871 -704 689 1028 955 81 407 550 198 1842 100 1195 408 -111 1123 1333 38 -162 -729 -59 349 435 697 507 383 205 371 376 -507 -309 -1803 -329 -626 -1007 -1463 -1696 -2359 -798 -291 374 -3 -200 563 335 286 167 752 582 1440 752 836 277 -191 -514 -628 -1222 -210 -203 -793 -611 -64 -537 134 1042 -250 503 -205 -175 162 -107 -404 741 -344 -438 -965 1185 1832 -274 448 -202 873 1501 1167 120 -484 -302 -150 344 -749 -201 -12 -232 242 -398 -642 -313 SS 20240902T145347.0Z 9011.620683 134 1 9.00 2 55.42 102.49 50.72 100.08 0.00 1 0.00 1 0 17 1.236e-02 6.971e-03 5.998e-03 3.029e-03 2.191614e-01 1.680297e-03 2.401262e-03 -6.000000e+00 7.882420e-03 228.90 -2.00 3.25 -2.00 316.12 0.00e+00 3.462861e-04 1.960530e-04 3.653079e-05 -6.000000e+00 3.708524e-04 292.83 -2.00 20.00 -2.00 315.27 0.00e+00 1.757 0.000 302.00 328.00 3 4.9214e+00 4.3591e-03 2.0031e-02 -6.0000e+00 1.9530e-02 1.9028e-02 4.8638e-03 1.0414e-02 -6.0000e+00 2.1079e-02 1.2422e-02 2.7781e-03 5.0405e-03 -6.0000e+00 1.2632e-02 -8.7829e-03 1.2415e-03 1.4067e-03 -6.0000e+00 5.2585e-03 5.4078e-04 5.0220e-04 1.0826e-04 2.2057e-05 -6.0000e+00 4.4672e-04 2.8182e-02 -3.3772e-05 12 9 1 12 1 1 99.98 28.41 0.36 0.02818 0.03196 8 5 1 5 0 998.990 36.25 20.00 28.41 33.19 0.0 988.61 -2072 -4103 -2036 -706 -2965 -3756 -2966 -297 1205 -2258 627 -3252 1083 2268 841 -2119 -272 3125 1193 666 3435 -311 1911 912 385 -1276 -944 397 -87 1041 851 1470 -710 -1139 -3366 3793 -1546 -235 162 -1232 -100 -887 -156 -1194 -829 -997 -941 503 -1369 207 1471 1646 620 1045 -65 956 726 863 245 1140 821 1118 1651 765 -860 -1286 627 -18 111 1320 320 0 -241 451 513 133 204 -2291 423 -1034 -1956 -734 -2330 -1337 -751 -743 -35 -169 530 421 -599 457 -259 222 693 677 688 308 -70 -217 -146 -719 -559 71 77 -472 -438 -212 -203 508 537 49 88 374 -140 -387 271 120 397 180 -223 -322 475 397 497 408 265 351 943 -16 -81 -212 51 -208 181 -25 -100 58 428 -200 -317 -416 -627 -419 -805 -427 -139 -568 -719 -592 -63 267 -537 149 -775 271 624 258 -716 -95 1088 437 251 1279 -122 751 376 165 -515 -407 162 -35 405 343 619 -318 -514 -1543 1664 -719 -124 91 -786 -68 -639 -114 -828 -571 -733 -677 349 -958 144 1054 1240 460 804 -52 771 592 701 199 930 698 1002 1452 698 -785 -1118 545 -16 102 1211 318 0 -249 445 472 121 172 -1914 357 -965 -1893 -764 -2473 -1492 -835 -876 -43 -213 659 505 -677 501 -268 238 720 761 797 387 -91 -282 -180 -845 -677 82 94 -614 -564 -285 -287 708 774 72 123 518 -182 -505 349 160 527 252 -322 -465 665 534 673 527 332 439 1223 -21 -110 -298 73 -311 268 -38 -160 94 698 -323 -497 -636 -950 SS 20240902T145739.9Z 9011.623379 137 1 54.69 2 54.60 103.11 49.92 100.70 0.00 1 0.00 1 0 17 7.873e-03 5.981e-03 1.902e-04 1.227e-04 2.172950e-01 6.857853e-05 2.416102e-03 -6.000000e+00 5.020384e-03 228.90 -2.00 3.25 -2.00 315.31 0.00e+00 3.143709e-04 6.759894e-06 3.932284e-05 -6.000000e+00 2.361998e-04 292.83 -2.00 20.00 -2.00 314.53 0.00e+00 1.721 0.000 302.00 328.00 3 6.9901e-01 1.7627e-04 1.9708e-02 -6.0000e+00 1.2439e-02 3.3595e-03 1.9573e-04 1.0337e-02 -6.0000e+00 1.3426e-02 1.0102e-03 1.1141e-04 5.0196e-03 -6.0000e+00 8.0455e-03 -3.4905e-03 4.8011e-05 1.3896e-03 -6.0000e+00 3.3492e-03 3.8684e-02 2.9626e-04 4.3552e-06 2.3617e-05 -6.0000e+00 2.8452e-04 2.8244e-02 -3.2301e-05 10 0 0 10 0 0 99.99 28.42 0.32 0.02824 0.03047 3496 337 1 5 0 15.640 36.25 20.01 28.42 33.28 0.0 989.74 -584 -1644 -1941 -2837 -2123 -671 230 667 341 -1090 -1864 -395 222 366 432 -25 -105 623 700 1208 846 569 1045 1049 613 332 -99 -380 168 1261 1313 950 918 -911 -2364 -1215 -697 -367 -102 -506 -1181 -866 -613 -680 -483 -241 -593 -339 -232 207 974 875 690 945 499 683 905 489 483 787 1129 1396 1224 1122 -23 -600 -206 -48 734 891 145 -67 -104 101 -114 -337 -343 -522 -218 -446 -1224 -1438 -1902 -1691 -938 -664 -341 -145 161 173 87 243 86 403 756 515 263 505 127 -489 -482 -500 -612 94 -113 -955 -660 -426 -167 337 415 210 66 48 -32 192 388 327 408 358 -44 -61 378 311 489 667 308 805 998 344 155 -92 -287 -78 106 -9 -236 117 87 -430 -343 -416 -692 -167 -498 -584 -821 -620 -191 68 198 109 -365 -608 -134 82 141 183 -11 -47 289 316 556 397 271 507 528 305 167 -49 -191 81 597 642 490 467 -475 -1240 -647 -385 -221 -68 -350 -888 -654 -473 -529 -375 -184 -445 -259 -175 157 733 694 555 789 415 578 770 417 410 674 1000 1260 1130 1068 -22 -542 -183 -42 675 858 146 -68 -105 101 -110 -312 -304 -449 -194 -418 -1191 -1480 -2042 -1868 -1064 -775 -405 -176 194 207 100 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