File name: Pandora257s1_AustinTX_20250829_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250902T192745.8Z 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_20250829_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: 20250829 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 20250829T134922.5Z 9372.575954 5 1 54.73 2 68.73 91.71 140.78 87.99 0.00 1 0.00 1 0 17 1.342e-02 5.839e-03 5.492e-04 1.914e-04 3.360220e-01 1.057784e-04 3.678035e-03 -6.000000e+00 8.562914e-03 229.07 -2.00 3.25 -2.00 317.13 0.00e+00 5.404836e-04 1.556288e-05 1.336721e-04 -6.000000e+00 4.028546e-04 293.02 -2.00 20.00 -2.00 316.20 0.00e+00 2.730 0.000 302.00 328.00 3 4.3999e-01 2.7883e-04 3.1041e-02 -6.0000e+00 2.1223e-02 2.4244e-03 3.1276e-04 1.6031e-02 -6.0000e+00 2.2902e-02 -1.3174e-02 1.8206e-04 7.7627e-03 -6.0000e+00 1.3724e-02 2.4684e-03 8.5706e-05 2.1536e-03 -6.0000e+00 5.7143e-03 1.6027e-02 -5.6486e-05 6.7005e-06 3.2694e-05 -6.0000e+00 4.8490e-04 2.4616e-02 -1.0696e-04 10 0 0 10 0 0 56.58 26.12 0.29 0.02462 0.02419 2020 195 1 5 0 27.090 33.75 20.01 26.12 35.09 0.0 994.34 -2992 -4086 -4581 -5579 -5518 -4070 -3048 -2430 -2541 -3658 -3974 -2103 -1086 -357 127 -224 -221 554 995 1409 1165 966 1242 1205 549 221 -362 -643 -182 957 1093 456 479 -1205 -2482 -1348 -849 -415 -22 -347 -786 -609 -298 -266 -110 -22 -317 -59 -77 377 1128 984 870 1118 644 823 890 430 578 957 1359 1606 1393 1175 108 -452 81 180 785 866 146 -45 -188 -2 -182 -405 -326 -459 -261 -573 -1341 -1558 -1905 -1680 -986 -698 -322 -155 140 171 111 264 231 451 688 476 201 319 -76 -610 -590 -491 -509 74 -253 -1029 -737 -409 -149 277 332 136 46 101 141 363 574 479 415 250 -153 -94 331 289 451 676 374 910 1007 270 134 -93 -228 -32 69 -36 -251 100 57 -448 -336 -357 -563 -337 -498 -567 -675 -642 -468 -369 -319 -362 -557 -641 -333 -193 -72 27 -52 -55 145 270 394 310 263 350 357 171 71 -115 -200 -55 295 358 152 169 -442 -925 -514 -334 -188 -11 -185 -436 -357 -171 -154 -64 -13 -184 -34 -45 225 708 630 593 764 459 601 630 306 427 682 1003 1263 1127 956 89 -362 65 146 647 750 132 -42 -176 -2 -159 -340 -265 -369 -221 -497 -1261 -1559 -1993 -1807 -1087 -789 -380 -182 163 198 124 284 243 471 733 540 238 400 -98 -782 -743 -600 -617 88 -318 -1335 -977 -555 -209 399 489 204 67 144 194 491 771 665 592 364 -228 -139 476 412 629 927 500 1227 1390 391 200 -142 -350 -51 114 -61 -425 172 99 -763 -566 -582 -930 SS 20250829T135437.1Z 9372.579596 8 1 54.74 2 67.59 92.39 139.70 88.68 0.00 1 0.00 1 0 17 1.193e-02 5.794e-03 4.523e-04 1.764e-04 3.209053e-01 9.764308e-05 3.518150e-03 -6.000000e+00 7.611293e-03 229.07 -2.00 3.25 -2.00 316.92 0.00e+00 4.563857e-04 1.366358e-05 1.184585e-04 -6.000000e+00 3.580678e-04 293.02 -2.00 20.00 -2.00 316.01 0.00e+00 2.601 0.000 302.00 328.00 3 4.2346e-01 2.5657e-04 2.9595e-02 -6.0000e+00 1.8865e-02 -4.3702e-04 2.8735e-04 1.5297e-02 -6.0000e+00 2.0357e-02 -1.0770e-02 1.6589e-04 7.4015e-03 -6.0000e+00 1.2199e-02 1.7832e-03 7.6981e-05 2.0421e-03 -6.0000e+00 5.0792e-03 1.8812e-02 -1.7983e-05 6.1909e-06 3.1384e-05 -6.0000e+00 4.3100e-04 2.5147e-02 -8.1446e-05 10 0 0 10 0 0 70.66 26.73 0.29 0.02515 0.02501 2205 213 1 5 0 24.820 35.00 20.01 26.73 35.18 0.0 994.81 -2805 -3050 -4289 -4917 -4829 -4004 -2650 -1806 -1571 -2913 -2585 -1956 -661 -109 74 -187 289 829 934 1558 1195 757 1235 1119 646 96 -512 -689 -143 963 962 576 681 -1200 -2436 -1318 -781 -427 55 -284 -845 -575 -218 -376 -149 -13 -306 -91 -78 312 1024 980 820 1113 708 722 932 428 467 783 1232 1526 1349 1177 84 -454 -18 201 830 929 138 -11 -95 12 -124 -406 -363 -595 -314 -538 -1302 -1550 -1906 -1695 -959 -682 -334 -144 163 164 109 279 192 433 725 472 164 348 -18 -592 -593 -510 -537 45 -153 -999 -721 -430 -180 304 379 141 65 91 75 278 521 433 378 292 -107 -31 366 314 436 656 366 857 977 311 131 -85 -245 -75 70 -10 -232 117 84 -423 -324 -391 -624 -377 -439 -629 -702 -661 -544 -377 -278 -239 -474 -442 -361 -136 -23 18 -50 76 229 269 460 362 235 395 351 213 32 -173 -226 -46 310 329 213 249 -457 -940 -520 -338 -200 28 -157 -489 -351 -130 -228 -90 -8 -184 -55 -47 192 662 645 575 782 518 542 677 313 340 574 935 1182 1119 982 71 -371 -15 165 694 817 127 -11 -91 11 -110 -345 -300 -484 -268 -470 -1233 -1562 -2010 -1839 -1066 -779 -387 -170 191 192 124 303 203 454 773 536 194 436 -24 -758 -746 -621 -651 54 -191 -1262 -958 -584 -252 439 558 211 95 129 103 373 693 596 535 422 -158 -45 524 444 604 894 486 1143 1334 444 194 -127 -371 -119 114 -16 -388 199 143 -711 -538 -630 -1019 SS 20250829T135943.3Z 9372.583140 11 1 54.74 2 66.49 93.05 138.65 89.35 0.00 1 0.00 1 0 17 1.059e-02 5.749e-03 3.878e-04 1.623e-04 3.072380e-01 8.997463e-05 3.374162e-03 -6.000000e+00 6.760707e-03 229.07 -2.00 3.25 -2.00 316.72 0.00e+00 4.105209e-04 1.200727e-05 1.116120e-04 -6.000000e+00 3.180347e-04 293.02 -2.00 20.00 -2.00 315.82 0.00e+00 2.488 0.000 302.00 328.00 3 3.8502e-01 2.3533e-04 2.8312e-02 -6.0000e+00 1.6757e-02 -8.0400e-04 2.6316e-04 1.4637e-02 -6.0000e+00 1.8082e-02 -8.3268e-03 1.5135e-04 7.0928e-03 -6.0000e+00 1.0835e-02 5.2329e-04 6.9485e-05 1.9579e-03 -6.0000e+00 4.5117e-03 2.2189e-02 7.4009e-05 5.7056e-06 3.0331e-05 -6.0000e+00 3.8282e-04 2.5300e-02 -6.5595e-05 10 0 0 10 0 0 37.39 27.18 0.29 0.02530 0.02586 2428 234 1 5 0 22.540 35.25 20.01 27.18 35.31 0.0 995.55 -2125 -3153 -3131 -4389 -4364 -2811 -1690 -1224 -1310 -2411 -3019 -1254 -667 -112 346 22 -37 879 810 1210 924 642 1010 1162 588 227 -367 -595 -77 1051 1145 641 674 -1028 -2442 -1364 -822 -347 -7 -337 -858 -488 -290 -442 -208 -46 -442 -177 -152 243 912 937 821 1041 601 789 927 503 499 855 1151 1507 1349 1167 93 -410 -42 126 810 938 188 -34 -94 7 -145 -390 -371 -537 -269 -507 -1269 -1503 -1882 -1692 -987 -721 -357 -157 139 169 108 302 163 403 718 454 217 387 27 -568 -542 -532 -586 65 -146 -1001 -727 -405 -145 344 380 172 85 79 26 260 476 404 403 310 -92 -45 382 324 451 657 283 825 982 306 127 -91 -268 -67 82 -28 -209 124 97 -414 -333 -394 -602 -306 -488 -488 -668 -636 -403 -254 -200 -231 -453 -599 -264 -145 -27 89 6 -11 274 245 377 295 210 339 409 204 81 -129 -217 -27 375 405 244 271 -428 -972 -555 -367 -168 -4 -194 -515 -294 -180 -278 -131 -29 -276 -109 -94 154 604 632 589 749 450 581 690 376 372 641 894 1195 1143 994 80 -341 -35 105 686 835 175 -33 -91 7 -131 -335 -308 -439 -230 -462 -1208 -1522 -1994 -1847 -1106 -831 -417 -187 165 200 123 329 173 422 765 514 257 484 35 -725 -679 -647 -707 77 -183 -1265 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