File name: Pandora257s1_AustinTX_20250415_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250416T063710.2Z 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_20250415_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: 20250415 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 20250415T151558.2Z 9236.636090 317 1 1.91 2 49.57 103.42 114.12 255.90 0.00 1 0.00 1 0 17 1.044e-02 7.120e-03 5.151e-03 3.357e-03 1.991331e-01 1.883795e-03 2.223392e-03 -6.000000e+00 6.656516e-03 229.29 -2.00 3.25 -2.00 315.24 0.00e+00 3.359807e-04 1.775959e-04 2.930308e-05 -6.000000e+00 3.051395e-04 286.60 -2.00 20.00 -2.00 314.55 0.00e+00 1.539 0.000 302.00 328.00 3 3.8287e+00 4.8429e-03 1.7799e-02 -6.0000e+00 1.6543e-02 3.6361e-03 5.3646e-03 9.4905e-03 -6.0000e+00 1.7879e-02 7.7696e-04 3.0601e-03 4.6201e-03 -6.0000e+00 1.0668e-02 -3.2853e-03 1.3104e-03 1.2800e-03 -6.0000e+00 4.3999e-03 2.0705e-03 -1.5149e-03 1.1935e-04 2.2176e-05 -6.0000e+00 3.7706e-04 3.6127e-02 -8.0931e-05 12 9 1 12 1 1 91.67 27.75 0.31 0.03613 0.02474 3 11 2 5 0 475.460 35.75 20.00 27.75 25.91 0.0 932.48 -1674 -3374 -3237 -2772 -2602 -134 -250 901 -8 -732 -812 -1106 -226 2367 838 187 1370 560 388 2311 2974 459 2380 294 -304 796 -953 -511 -769 846 2696 1315 199 -299 -3411 217 -2055 650 -1485 -789 -856 -784 -121 -1013 -854 -192 -753 -486 -1041 -554 772 650 953 433 1429 455 1292 312 478 1061 1675 1268 969 665 -510 -384 -882 330 845 797 -207 370 -67 -105 74 -545 50 -176 -94 -581 -341 -1165 -2161 -1505 -898 -924 -433 -260 20 313 345 407 399 319 585 531 616 1051 36 -477 -887 -529 -382 677 -158 -1224 -620 -921 -91 407 291 136 104 42 4 54 186 236 857 661 -146 -166 57 670 672 686 671 133 1005 -62 -285 94 -509 77 94 -40 -445 159 -29 -189 -255 -466 -316 -496 -1060 -1005 -815 -722 -39 -70 268 -2 -244 -278 -399 -82 921 362 81 612 260 185 1109 1437 230 1195 147 -157 411 -490 -251 -388 415 1333 690 102 -155 -1809 114 -1203 399 -1014 -569 -634 -608 -95 -812 -681 -150 -580 -364 -772 -412 587 520 796 360 1208 396 1123 273 417 928 1509 1157 895 633 -482 -359 -787 301 769 752 -212 374 -68 -107 71 -503 44 -151 -83 -535 -329 -1182 -2369 -1670 -1014 -1109 -522 -322 24 369 395 447 424 330 625 587 716 1264 45 -600 -1071 -625 -437 785 -195 -1555 -793 -1237 -122 571 408 191 146 55 5 67 230 301 1109 905 -201 -228 76 888 880 857 839 167 1249 -81 -379 128 -692 108 134 -60 -664 241 -44 -284 -386 -690 -461 SS 20250415T152912.0Z 9236.645277 323 1 43.30 2 46.81 105.73 116.81 257.18 0.00 1 0.00 1 0 17 7.910e-03 5.961e-03 9.685e-04 6.411e-04 1.887744e-01 3.606050e-04 2.097202e-03 -6.000000e+00 5.053133e-03 229.29 -2.00 3.25 -2.00 315.14 0.00e+00 2.666212e-04 3.336519e-05 2.901774e-05 -6.000000e+00 2.312428e-04 286.60 -2.00 20.00 -2.00 314.47 0.00e+00 1.459 0.000 302.00 328.00 3 3.9887e+00 9.2661e-04 1.6861e-02 -6.0000e+00 1.2559e-02 9.9501e-03 1.0259e-03 8.9751e-03 -6.0000e+00 1.3565e-02 2.1844e-03 5.8460e-04 4.3631e-03 -6.0000e+00 8.0946e-03 -3.8464e-03 2.4978e-04 1.2117e-03 -6.0000e+00 3.3452e-03 1.9391e-03 2.9864e-04 2.2838e-05 2.0676e-05 -6.0000e+00 2.8580e-04 2.5321e-02 -3.5112e-05 12 1 1 12 1 1 99.99 27.75 0.37 0.02532 0.02757 186 23 1 5 0 231.530 35.75 20.00 27.75 26.98 0.0 941.07 -934 -1587 -2235 -2200 -2700 -569 825 624 603 -1266 -769 -399 106 787 808 -360 -381 654 866 1153 1420 590 1156 1178 419 243 -199 -480 151 1476 1216 824 728 -802 -2369 -315 -1124 -328 -246 -585 -1262 -907 -559 -807 -447 -421 -892 -445 -375 87 924 1101 487 1059 426 493 835 446 362 834 1197 1347 1239 820 -43 -636 54 52 807 853 146 133 -183 198 -11 -313 -136 -546 -158 -393 -1168 -1342 -1952 -1692 -758 -612 -351 -139 111 199 73 223 19 372 756 536 358 536 92 -505 -481 -395 -460 142 -97 -945 -659 -385 -176 288 438 133 66 94 -81 144 325 358 362 268 -84 -77 312 395 467 682 292 717 1000 284 60 -141 -237 -71 124 33 -279 121 205 -333 -388 -449 -649 -289 -514 -719 -672 -783 -159 238 194 200 -441 -273 -136 39 318 355 -158 -174 305 414 561 698 296 588 620 214 125 -108 -250 75 712 602 428 391 -438 -1300 -174 -636 -197 -171 -429 -950 -712 -447 -651 -358 -332 -691 -334 -293 68 701 874 408 914 360 423 720 385 311 722 1069 1268 1168 796 -41 -581 49 46 751 816 143 136 -187 194 -10 -293 -117 -482 -143 -366 -1144 -1363 -2132 -1867 -882 -722 -433 -168 134 240 86 242 21 382 798 584 426 657 113 -616 -586 -476 -539 169 -117 -1164 -850 -518 -237 405 609 185 92 123 -103 181 403 458 470 368 -114 -104 415 524 590 854 354 864 1245 374 78 -191 -330 -98 179 48 -420 185 315 -508 -576 -650 -930 SS 20250415T153710.8Z 9236.650819 326 1 1.78 2 45.15 107.20 118.44 257.95 0.00 1 0.00 1 0 17 9.074e-03 7.009e-03 5.667e-03 3.915e-03 1.794754e-01 2.201879e-03 2.008761e-03 -6.000000e+00 5.795761e-03 229.29 -2.00 3.25 -2.00 314.95 0.00e+00 8.076492e-05 1.960782e-04 4.093715e-05 -6.000000e+00 2.652868e-04 286.60 -2.00 20.00 -2.00 314.29 0.00e+00 1.416 0.000 302.00 328.00 3 4.1008e+00 5.6485e-03 1.6280e-02 -6.0000e+00 1.4405e-02 -3.9532e-04 6.2525e-03 8.5594e-03 -6.0000e+00 1.5560e-02 9.5535e-03 3.5648e-03 4.1660e-03 -6.0000e+00 9.2846e-03 -4.8117e-03 1.5096e-03 1.1466e-03 -6.0000e+00 3.8363e-03 1.8435e-03 3.1260e-04 1.3928e-04 2.0478e-05 -6.0000e+00 3.2786e-04 2.5308e-02 -8.3990e-05 12 9 1 12 1 1 999.00 27.75 0.26 0.02531 0.02766 2 9 1 5 0 592.300 35.75 20.00 27.75 27.88 0.0 947.09 699 -2689 261 -3295 -2406 -66 814 402 177 -1199 -952 -318 -1366 1642 1070 -847 1494 107 1327 1108 1148 -674 990 1155 2039 -94 -332 -176 929 676 -202 -750 -217 -808 -2429 769 -1679 182 -615 -989 -1111 -458 -743 -274 -1016 -189 24 -929 -462 126 1402 864 610 1544 -423 500 954 624 -463 851 1024 1271 1632 947 -580 -147 203 583 1489 604 -285 380 -93 577 202 -499 6 -1246 -406 -753 -1645 -1595 -2023 -1533 -733 -758 -299 55 319 340 526 21 112 224 296 1412 674 653 -473 -405 -688 -586 -461 -367 -474 -864 -701 191 79 449 313 -85 -68 213 -412 435 543 496 219 525 148 -665 541 -94 257 555 566 405 1168 417 215 -220 77 -125 -305 17 -378 451 181 -232 -150 -562 -779 230 -951 88 -1095 -749 -20 253 135 63 -450 -364 -117 -551 707 470 -402 720 54 676 578 606 -343 506 611 1102 -52 -181 -92 488 350 -108 -393 -116 -438 -1323 415 -1016 116 -431 -739 -852 -365 -606 -224 -832 -152 19 -749 -364 99 1127 695 514 1339 -365 435 832 545 -408 748 930 1160 1561 934 -569 -136 185 522 1387 587 -287 393 -96 576 198 -472 5 -1108 -368 -708 -1633 -1645 -2145 -1715 -832 -879 -362 68 392 403 603 23 120 232 317 1543 777 780 -593 -501 -817 -685 -524 -427 -583 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