File name: Pandora257s1_AustinTX_20240419_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240420T063312.5Z 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_20240419_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: 20240419 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 20240419T154131.7Z 8875.653839 283 1 5.62 2 43.26 106.42 140.84 1.21 0.00 1 0.00 1 0 17 1.307e-02 8.256e-03 6.754e-03 4.315e-03 1.717587e-01 2.415574e-03 1.920838e-03 -6.000000e+00 8.362348e-03 229.56 -2.00 3.25 -2.00 315.26 0.00e+00 1.085687e-04 2.295993e-04 2.021244e-05 -6.000000e+00 3.827357e-04 286.98 -2.00 20.00 -2.00 314.57 0.00e+00 1.371 0.000 302.00 328.00 3 5.3403e+00 6.2255e-03 1.5729e-02 -6.0000e+00 2.0795e-02 1.0773e-02 6.9000e-03 8.2284e-03 -6.0000e+00 2.2453e-02 1.3151e-02 3.9303e-03 3.9982e-03 -6.0000e+00 1.3398e-02 -8.9104e-03 1.6878e-03 1.1031e-03 -6.0000e+00 5.5391e-03 5.6303e-04 2.8318e-04 1.5321e-04 1.8927e-05 -6.0000e+00 4.7235e-04 2.1060e-02 -8.6861e-05 12 9 1 12 33 1 999.00 27.73 0.37 0.02106 0.02319 2 3 1 5 0 1871.300 35.75 20.00 27.73 25.42 0.0 939.46 -1534 -1945 -1434 2813 -5638 -5741 1105 -2088 707 -1931 -1156 -387 -998 1023 3287 -757 320 2669 1845 1710 319 -537 1764 833 -220 1252 -1788 -39 -209 1906 3402 -454 415 -1401 -3859 277 -2167 -1210 -914 150 -302 -181 -399 813 -696 -996 -1722 66 320 -433 1250 2132 504 1449 1699 487 575 729 -84 961 433 1146 1887 1505 -831 -980 5 -146 264 1192 -501 -296 -651 535 -769 1218 291 -1332 -1486 -654 -1945 -1096 -2710 -1011 -31 -1037 -381 217 388 316 -31 -36 -563 -130 609 1082 384 803 -131 -136 -345 -699 -109 16 75 -851 -231 -355 307 294 1132 316 199 53 -394 -131 -129 -91 -340 232 507 -646 523 524 339 254 660 1025 638 67 -206 -38 535 -21 19 192 -528 253 831 -487 -417 -841 -798 -448 -592 -428 763 -1570 -1572 295 -620 217 -629 -381 -132 -369 407 1273 -324 140 1177 840 797 153 -261 857 422 -116 657 -945 -19 -99 870 1559 -225 210 -722 -2013 142 -1239 -722 -626 106 -231 -145 -327 661 -572 -809 -1374 50 238 -326 954 1688 424 1252 1401 413 491 620 -72 821 385 1065 1832 1503 -832 -927 5 -127 240 1160 -498 -305 -674 529 -770 1095 260 -1163 -1333 -587 -1939 -1103 -2959 -1150 -35 -1257 -481 265 470 391 -36 -40 -595 -133 634 1204 441 989 -160 -174 -423 -814 -130 19 91 -1103 -294 -473 425 403 1583 445 270 71 -522 -163 -159 -116 -435 312 702 -906 710 684 447 319 795 1224 791 88 -279 -50 717 -29 27 277 -792 384 1265 -741 -618 -1221 -1143 SS 20240419T154536.8Z 8875.656676 286 1 54.68 2 42.41 107.21 140.83 2.75 0.00 1 0.00 1 0 17 7.482e-03 6.068e-03 3.276e-04 2.446e-04 1.739841e-01 1.383556e-04 1.941433e-03 -6.000000e+00 4.787528e-03 229.56 -2.00 3.25 -2.00 314.55 0.00e+00 3.612354e-04 1.148239e-05 1.635308e-05 -6.000000e+00 2.190610e-04 286.98 -2.00 20.00 -2.00 313.93 0.00e+00 1.353 0.000 302.00 328.00 3 2.5122e+00 3.5384e-04 1.5620e-02 -6.0000e+00 1.1906e-02 7.3394e-03 3.9086e-04 8.2985e-03 -6.0000e+00 1.2853e-02 9.8684e-04 2.2341e-04 4.0274e-03 -6.0000e+00 7.6699e-03 -3.9662e-03 9.3713e-05 1.1322e-03 -6.0000e+00 3.1716e-03 9.6885e-03 2.7373e-04 8.6780e-06 2.0074e-05 -6.0000e+00 2.7036e-04 2.1397e-02 -1.4854e-05 10 0 0 10 0 0 99.77 27.73 0.33 0.02140 0.02345 542 52 1 5 0 100.880 35.75 20.00 27.73 25.79 0.0 943.03 -165 -1327 -1713 -2362 -1831 -244 638 996 565 -803 -1501 -234 288 501 561 -50 -114 510 667 1224 930 565 1079 954 534 326 -58 -412 122 1236 1411 987 981 -694 -2224 -1090 -603 -501 -149 -554 -1203 -1060 -762 -820 -606 -364 -732 -404 -343 176 931 883 688 981 428 646 784 460 442 786 1052 1354 1158 1037 -59 -682 -172 -97 684 943 151 -1 -30 157 -12 -326 -317 -558 -199 -372 -1156 -1420 -1809 -1700 -906 -656 -322 -124 152 189 89 280 117 339 755 598 277 530 163 -405 -495 -425 -555 44 -79 -910 -674 -421 -251 318 398 170 81 52 -67 173 361 324 374 395 -14 -82 358 326 450 680 343 721 992 329 121 -120 -297 -99 88 66 -262 96 109 -407 -345 -381 -707 -63 -535 -684 -900 -695 -89 241 379 230 -341 -619 -99 131 237 273 -26 -62 269 359 669 517 318 614 562 311 192 -33 -239 67 694 806 561 575 -414 -1330 -657 -376 -341 -107 -431 -978 -868 -636 -689 -506 -299 -610 -326 -271 139 752 747 587 866 376 575 702 412 395 707 977 1277 1114 1024 -57 -656 -160 -89 630 907 152 -1 -31 159 -12 -304 -282 -494 -180 -351 -1129 -1463 -1939 -1873 -1025 -764 -382 -150 183 226 103 305 126 352 803 664 317 635 198 -491 -591 -493 -644 51 -93 -1114 -863 -547 -332 425 549 235 110 68 -84 210 433 402 477 518 -19 -109 476 417 562 830 416 868 1230 418 156 -156 -394 -132 123 94 -377 141 161 -595 -491 -543 -998 SS 20240419T155046.2Z 8875.660258 289 1 54.50 2 41.35 108.23 140.78 4.68 0.00 1 0.00 1 0 17 9.519e-03 6.760e-03 1.549e-03 1.035e-03 1.705219e-01 5.811335e-04 1.891797e-03 -6.000000e+00 6.091698e-03 229.56 -2.00 3.25 -2.00 315.08 0.00e+00 2.948861e-04 5.335710e-05 2.001898e-05 -6.000000e+00 2.787129e-04 286.98 -2.00 20.00 -2.00 314.42 0.00e+00 1.331 0.000 302.00 328.00 3 5.2281e+00 1.4927e-03 1.5345e-02 -6.0000e+00 1.5149e-02 2.4385e-02 1.6520e-03 8.1280e-03 -6.0000e+00 1.6354e-02 6.9349e-03 9.4239e-04 3.9457e-03 -6.0000e+00 9.7591e-03 -6.4226e-03 4.0229e-04 1.1040e-03 -6.0000e+00 4.0359e-03 6.5372e-04 3.9401e-04 3.6818e-05 1.8678e-05 -6.0000e+00 3.4398e-04 2.1128e-02 -5.5561e-06 11 8 0 10 0 0 99.88 27.74 0.30 0.02113 0.02409 38 4 1 5 0 1433.980 35.75 20.00 27.74 26.14 0.0 945.40 -762 -2467 -1365 -872 -3891 -1646 -447 -351 792 -961 -1687 -1180 420 1397 1544 -538 -869 1608 1058 1825 1475 735 2277 950 496 -123 -472 -132 -868 1774 1472 896 680 -866 -3209 776 -1794 -919 -120 -524 -659 -354 -504 -684 -364 -472 -1220 -214 -618 26 681 1790 366 878 -220 821 741 385 283 720 510 1258 1942 981 -716 -939 136 -42 442 1227 -118 465 102 380 120 252 -606 -1292 -333 -552 -1326 -1597 -2220 -1663 -670 -651 -421 -43 223 209 142 244 72 203 734 977 649 519 58 -261 -518 -455 -519 95 -27 -869 -636 -27 -181 542 537 245 117 125 -273 220 120 125 101 225 -52 -120 315 542 44 497 310 697 989 179 -36 -267 -258 -9 -27 126 -191 216 479 -270 -428 -570 -586 -241 -823 -444 -268 -1159 -470 -131 -111 262 -334 -602 -436 151 545 654 -247 -415 769 521 910 747 378 1176 473 256 -64 -242 -70 -441 862 731 465 364 -471 -1764 418 -996 -577 -80 -393 -498 -279 -406 -556 -293 -375 -952 -172 -488 20 549 1393 302 746 -194 726 661 344 252 645 473 1144 1845 964 -701 -869 125 -38 417 1164 -121 495 102 392 116 238 -531 -1094 -286 -513 -1276 -1673 -2352 -1858 -788 -768 -519 -54 280 253 170 269 79 213 787 1057 767 625 73 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