File name: Pandora257s1_AustinTX_20250603_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250604T063251.7Z 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_20250603_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: 20250603 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 20250603T154048.2Z 9285.653336 211 1 54.09 2 38.34 91.48 129.03 54.38 0.00 1 0.00 1 0 17 2.419e-02 1.219e-02 5.333e-03 2.760e-03 1.632334e-01 1.531695e-03 1.776068e-03 -6.000000e+00 1.553727e-02 230.96 -2.00 3.25 -2.00 316.13 0.00e+00 -1.598919e-04 1.759435e-04 6.166918e-05 -6.000000e+00 7.184085e-04 290.44 -2.00 20.00 -2.00 315.29 0.00e+00 1.274 0.000 302.00 328.00 3 6.7774e+00 4.0020e-03 1.4694e-02 -6.0000e+00 3.8722e-02 -3.1710e-02 4.4554e-03 7.7807e-03 -6.0000e+00 4.1752e-02 4.4779e-02 2.5392e-03 3.7530e-03 -6.0000e+00 2.4938e-02 -1.9974e-02 1.1174e-03 1.0217e-03 -6.0000e+00 1.0311e-02 1.5009e-04 6.7807e-04 9.9229e-05 1.6521e-05 -6.0000e+00 8.7450e-04 2.6834e-02 -9.7883e-05 12 9 8 11 8 0 99.99 28.57 0.79 0.02683 0.03193 21 2 1 5 0 2575.490 36.25 19.99 28.57 33.72 0.0 988.28 -1549 -3836 -3454 7078 -8118 -3761 -8167 -3939 477 -10 -1154 -3758 -1849 2023 5252 -2800 572 4002 2399 1514 8806 -1062 6802 1676 3189 -2588 -1666 737 -2751 2061 4763 950 -3555 -1556 -7083 7637 -3733 -1963 -523 94 1340 -839 145 -1814 -455 -2708 -2931 1118 -266 752 853 4392 -190 3002 -124 456 362 -851 1254 103 195 685 3141 -551 -2125 -1808 1925 537 -379 1505 316 1031 -562 389 784 385 1678 -3192 -942 -748 -1885 -1823 -3597 -1498 293 -810 267 788 281 456 -703 -128 1147 363 788 1928 481 332 -799 -648 437 -1253 523 143 -108 -848 -350 141 139 1333 487 312 -241 569 -512 -456 -257 -355 183 -441 -24 -723 -531 1945 -384 339 759 -250 459 -325 -351 -556 160 355 -388 -84 18 478 1418 718 -717 -1027 -457 -330 -865 -764 1338 -1691 -742 -1770 -884 109 -2 -283 -988 -515 595 1620 -991 203 1412 883 575 3153 -425 2574 692 1339 -1161 -723 298 -1102 774 1776 382 -1540 -660 -3144 3006 -1805 -1069 -294 59 892 -596 104 -1337 -330 -1975 -2087 743 -176 494 579 3012 -142 2262 -99 367 294 -699 1006 84 166 612 2876 -535 -2045 -1634 1583 442 -331 1397 318 1067 -591 391 735 331 1316 -2530 -752 -644 -1799 -1886 -3705 -1603 328 -974 332 1002 358 557 -811 -148 1209 375 834 2172 549 407 -1028 -822 523 -1448 632 164 -131 -1093 -470 197 203 2004 699 448 -361 791 -667 -563 -314 -449 245 -627 -35 -1061 -762 2615 -502 419 984 -327 564 -421 -472 -769 225 515 -593 -134 30 738 2181 1188 -1174 -1647 -721 SS 20250603T154847.0Z 9285.658878 217 1 54.69 2 36.62 92.57 127.69 56.12 0.00 1 0.00 1 0 17 9.752e-03 6.885e-03 1.572e-03 1.044e-03 1.668775e-01 5.893553e-04 1.849306e-03 -6.000000e+00 6.266174e-03 230.96 -2.00 3.25 -2.00 315.13 0.00e+00 1.203732e-04 5.499912e-05 2.076044e-05 -6.000000e+00 2.896528e-04 290.45 -2.00 20.00 -2.00 314.40 0.00e+00 1.245 0.000 302.00 328.00 3 5.3250e+00 1.5188e-03 1.4589e-02 -6.0000e+00 1.5617e-02 -2.5258e-03 1.6796e-03 7.9949e-03 -6.0000e+00 1.6837e-02 9.6698e-03 9.5731e-04 3.8722e-03 -6.0000e+00 1.0057e-02 -7.5827e-03 4.0831e-04 1.0584e-03 -6.0000e+00 4.1590e-03 6.5509e-04 4.0429e-04 3.7323e-05 1.8149e-05 -6.0000e+00 3.5260e-04 2.6580e-02 -4.9467e-05 11 9 0 11 32 0 99.55 28.57 0.40 0.02658 0.02962 36 3 1 5 0 1519.080 36.50 20.00 28.57 34.16 0.0 991.41 -785 -2196 -2405 -195 -4186 -1738 144 97 756 -272 -720 -923 -48 1626 852 -31 -393 1505 1310 1465 2584 184 1948 1422 826 -43 -576 -547 -168 1197 1262 1038 -288 -574 -3529 -1497 -2003 -491 -225 -384 -719 -1428 -512 -775 -803 -797 -1377 70 -313 53 1035 1515 623 1352 501 532 378 440 530 652 1051 1353 1883 590 -656 -880 541 158 709 1128 87 299 -70 147 349 209 -15 -1283 -292 -679 -1443 -1378 -2287 -1535 -603 -672 -175 -106 388 125 -156 192 70 461 625 1114 424 429 5 -354 -378 -558 -382 -152 -11 -818 -699 -216 -22 523 456 -15 11 279 -171 -8 131 70 226 110 -16 -244 -14 660 288 535 371 988 959 41 -33 -209 7 123 145 -79 -267 171 399 -37 -435 -784 -531 -246 -723 -781 -59 -1236 -493 42 30 250 -93 -253 -339 -17 631 361 -14 -185 713 637 725 1281 94 1001 759 422 -22 -293 -287 -84 580 622 532 -154 -308 -1924 -819 -1109 -306 -150 -286 -540 -1128 -410 -624 -643 -630 -1065 55 -244 41 824 1173 509 1134 434 469 336 389 467 580 965 1223 1780 577 -636 -805 491 142 664 1067 90 316 -75 150 334 195 -13 -1080 -250 -632 -1388 -1438 -2418 -1708 -707 -792 -215 -133 485 151 -186 210 76 481 671 1204 503 517 7 -440 -450 -667 -444 -181 -13 -1034 -925 -282 -30 738 628 -20 15 363 -219 -10 157 87 297 145 -22 -333 -19 886 369 651 462 1217 1221 52 -44 -284 10 167 206 -118 -391 255 596 -55 -630 -1171 -782 SS 20250603T155331.4Z 9285.662169 220 1 54.42 2 35.60 93.23 126.88 57.12 0.00 1 0.00 1 0 17 8.217e-03 6.249e-03 1.081e-03 7.614e-04 1.643038e-01 4.312351e-04 1.821371e-03 -6.000000e+00 5.280099e-03 230.96 -2.00 3.25 -2.00 314.85 0.00e+00 1.852259e-04 3.787247e-05 2.269098e-05 -6.000000e+00 2.440606e-04 290.45 -2.00 20.00 -2.00 314.14 0.00e+00 1.229 0.000 302.00 328.00 3 4.7889e+00 1.1095e-03 1.4381e-02 -6.0000e+00 1.3159e-02 -3.8131e-03 1.2259e-03 7.8559e-03 -6.0000e+00 1.4188e-02 6.6064e-03 6.9918e-04 3.8051e-03 -6.0000e+00 8.4744e-03 -5.9654e-03 2.9509e-04 1.0433e-03 -6.0000e+00 3.5046e-03 1.1446e-03 2.7825e-04 2.7111e-05 1.8520e-05 -6.0000e+00 2.9710e-04 2.6593e-02 -4.0085e-05 10 0 0 10 0 0 96.80 28.57 0.33 0.02659 0.02868 57 6 1 5 0 954.620 36.50 20.00 28.57 34.33 0.0 992.83 -713 -1347 -2043 -1685 -3189 -660 204 1049 609 -766 -1143 -295 599 898 828 -579 -303 889 895 1284 1741 558 1540 1229 551 -213 -609 -489 167 1110 1869 1008 206 -590 -2394 84 -1447 -386 -293 -466 -840 -929 -448 -821 -655 -645 -1352 -360 -325 148 808 1313 573 1164 537 364 625 295 540 893 1096 1195 1398 944 -405 -681 98 -127 691 990 150 94 -48 294 43 56 -69 -829 -349 -427 -1292 -1397 -2060 -1600 -697 -663 -308 -57 166 315 125 138 -25 394 702 820 335 505 -42 -525 -282 -664 -406 -127 -80 -878 -644 -289 -201 541 429 319 110 126 -136 -21 227 260 278 209 -20 -243 236 587 283 582 364 689 1010 244 36 -239 -180 52 32 19 -212 187 171 -175 -323 -664 -565 -250 -493 -740 -575 -1042 -207 66 362 224 -295 -449 -120 239 392 391 -273 -148 439 452 659 900 295 820 678 315 -124 -346 -265 86 554 942 532 112 -325 -1325 46 -886 -249 -203 -363 -666 -771 -377 -698 -553 -536 -1102 -282 -250 113 633 1070 492 1028 462 318 549 259 472 786 997 1145 1330 923 -392 -658 88 -113 640 938 153 100 -51 301 41 52 -62 -728 -313 -392 -1239 -1455 -2189 -1794 -785 -794 -368 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