File name: Pandora257s1_AustinTX_20250328_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250329T064230.3Z 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_20250328_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: 20250328 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 20250328T184943.3Z 9218.784529 275 1 53.85 2 27.12 187.57 33.16 203.04 0.00 1 0.00 1 0 17 9.249e-03 6.930e-03 1.633e-03 1.121e-03 1.611886e-01 6.248593e-04 1.793406e-03 -6.000000e+00 5.880090e-03 227.94 -2.00 3.25 -2.00 314.96 0.00e+00 2.835200e-04 5.605451e-05 1.770600e-05 -6.000000e+00 2.690458e-04 285.38 -2.00 20.00 -2.00 314.33 0.00e+00 1.123 0.000 302.00 328.00 3 5.5857e+00 1.5995e-03 1.3372e-02 -6.0000e+00 1.4573e-02 9.0538e-03 1.7747e-03 7.5987e-03 -6.0000e+00 1.5759e-02 7.7780e-03 1.0110e-03 3.7160e-03 -6.0000e+00 9.4068e-03 -6.7560e-03 4.2909e-04 1.0454e-03 -6.0000e+00 3.8936e-03 5.7127e-04 2.3816e-04 3.9728e-05 1.8047e-05 -6.0000e+00 3.3402e-04 2.3343e-02 -7.5853e-05 11 9 0 11 32 0 69.03 27.75 0.46 0.02334 0.02513 27 3 1 5 0 1994.270 35.75 20.00 27.75 26.89 0.0 940.13 -751 -1529 -2029 -707 -4150 -1204 79 -87 435 -1002 -949 -790 588 938 1387 -474 33 1426 1209 1339 2818 652 216 1588 543 -273 -596 -15 190 1093 1370 184 154 -783 -2719 -1557 -1853 -625 -307 -262 -732 -612 -1004 -960 -740 -633 -1140 39 -160 -101 968 1418 563 1430 551 660 1028 434 599 803 1260 1547 2035 759 -747 -792 -26 -194 575 1133 175 340 -100 285 -350 -132 134 -1234 -243 -674 -1511 -1398 -2166 -1702 -782 -790 -206 -190 270 337 13 -34 133 276 631 962 433 457 -121 -256 -288 -572 -293 137 76 -823 -730 -145 -314 545 557 180 162 149 -115 8 193 83 192 178 74 -151 634 91 322 697 606 693 834 126 -141 -318 -183 146 103 130 -208 252 275 16 -539 -772 -607 -251 -532 -698 -227 -1298 -358 24 -29 151 -363 -350 -303 239 381 607 -223 16 700 608 686 1438 343 116 868 285 -145 -336 -8 97 541 687 97 83 -427 -1490 -861 -1033 -392 -221 -196 -592 -482 -810 -777 -595 -536 -945 31 -124 -79 768 1171 456 1190 474 575 898 380 522 705 1139 1470 2021 732 -714 -761 -23 -172 528 1118 175 352 -104 286 -352 -122 121 -1085 -217 -609 -1505 -1414 -2357 -1953 -890 -956 -259 -232 327 416 16 -38 138 279 652 1063 493 559 -154 -324 -348 -657 -347 155 92 -1055 -926 -191 -432 734 770 249 228 195 -149 10 233 103 253 234 100 -206 841 117 415 851 714 862 1006 159 -186 -433 -240 196 146 191 -302 372 408 24 -775 -1146 -889 SS 20250328T185500.5Z 9218.788200 278 1 55.15 2 27.29 190.43 33.59 205.26 0.00 1 0.00 1 0 17 8.605e-03 6.411e-03 1.349e-03 9.409e-04 1.608510e-01 5.264799e-04 1.793184e-03 -6.000000e+00 5.471172e-03 227.94 -2.00 3.25 -2.00 314.88 0.00e+00 3.338779e-04 4.632903e-05 1.844763e-05 -6.000000e+00 2.502957e-04 285.38 -2.00 20.00 -2.00 314.25 0.00e+00 1.125 0.000 302.00 328.00 3 5.3093e+00 1.3477e-03 1.3383e-02 -6.0000e+00 1.3560e-02 8.5245e-03 1.4928e-03 7.5953e-03 -6.0000e+00 1.4663e-02 5.9121e-03 8.5227e-04 3.7125e-03 -6.0000e+00 8.7524e-03 -5.7895e-03 3.6148e-04 1.0549e-03 -6.0000e+00 3.6231e-03 7.5299e-04 3.5624e-04 3.3461e-05 1.8268e-05 -6.0000e+00 3.1075e-04 2.3322e-02 -4.5379e-05 11 8 0 10 0 0 99.02 27.76 0.29 0.02332 0.02600 38 4 1 5 0 1451.030 35.75 20.00 27.76 27.26 0.0 944.39 -628 -1696 -1622 -1444 -3639 -733 -171 554 652 -545 -1261 -591 603 1269 -605 -600 96 1075 993 1321 2494 478 1785 1163 829 -355 -573 -260 -193 1190 1621 581 279 -566 -2679 606 -1769 -580 -232 -382 -916 -755 -432 -910 -884 -551 -1182 4 -392 -298 864 1382 655 1087 438 483 681 422 568 751 1044 1298 1257 969 -497 -671 55 6 596 1124 185 194 -109 141 -198 94 155 -869 -323 -575 -1464 -1442 -2176 -1630 -789 -733 -219 15 205 305 -28 46 53 382 728 885 347 588 12 -374 -337 -521 -375 195 -46 -788 -640 -213 -284 503 539 190 172 120 -274 -149 213 163 249 228 36 -103 437 240 276 505 419 591 831 237 -130 -188 -66 50 -24 46 -278 172 330 -53 -294 -679 -643 -209 -591 -556 -467 -1235 -237 -57 197 226 -196 -465 -225 244 558 -271 -284 47 532 503 680 1282 252 947 640 471 -205 -324 -140 -99 589 813 305 151 -309 -1470 328 -1069 -367 -168 -289 -751 -605 -352 -750 -723 -443 -992 3 -310 -235 695 1156 540 923 383 429 606 375 503 670 961 1256 1203 951 -484 -655 50 6 555 1061 188 205 -115 144 -190 88 133 -770 -292 -527 -1482 -1490 -2281 -1801 -920 -859 -268 18 255 365 -33 51 56 393 767 999 404 698 15 -460 -396 -613 -428 227 -57 -979 -833 -274 -381 699 768 271 236 153 -345 -186 263 197 319 309 48 -137 597 316 345 634 507 710 1028 291 -166 -248 -88 69 -33 67 -396 249 480 -76 -435 -984 -920 SS 20250328T190012.7Z 9218.791814 281 1 54.81 2 27.52 193.20 34.05 207.39 0.00 1 0.00 1 0 17 8.438e-03 6.218e-03 1.333e-03 9.311e-04 1.621781e-01 5.213333e-04 1.805296e-03 -6.000000e+00 5.365757e-03 227.94 -2.00 3.25 -2.00 314.87 0.00e+00 2.165514e-04 4.581768e-05 2.108402e-05 -6.000000e+00 2.454422e-04 285.38 -2.00 20.00 -2.00 314.24 0.00e+00 1.127 0.000 302.00 328.00 3 5.2763e+00 1.3342e-03 1.3432e-02 -6.0000e+00 1.3299e-02 1.0992e-02 1.4782e-03 7.6367e-03 -6.0000e+00 1.4380e-02 4.9477e-03 8.4374e-04 3.7383e-03 -6.0000e+00 8.5836e-03 -5.5273e-03 3.5738e-04 1.0448e-03 -6.0000e+00 3.5536e-03 7.7434e-04 4.0764e-04 3.3043e-05 1.8366e-05 -6.0000e+00 3.0472e-04 2.3136e-02 -2.4852e-05 10 0 0 10 0 0 99.96 27.77 0.36 0.02314 0.02620 46 4 1 5 0 1191.340 35.75 20.00 27.77 27.82 0.0 948.28 -1069 -2226 -2025 -1575 -3212 -494 -528 995 301 -987 -835 -1019 524 1182 1066 -440 -107 1198 1232 1480 1810 360 1732 989 628 -514 -318 -324 59 1193 1376 432 605 -447 -2473 -1712 -27 -396 -439 -424 -853 -780 -590 -816 -667 -471 -1338 -34 -503 14 810 1239 622 1161 499 629 818 386 509 716 967 1310 1661 912 -604 -638 102 93 501 966 4 370 -179 70 -22 -77 -274 -1073 -472 -605 -1398 -1369 -1939 -1440 -712 -615 -191 -70 239 252 98 -110 87 243 543 722 362 354 30 -305 -439 -464 -323 138 -45 -906 -581 -211 -107 371 455 87 82 228 -19 -32 145 160 306 258 -1 -74 339 619 315 600 516 537 942 184 -27 -212 -280 -58 33 -33 -50 91 331 -150 -369 -641 -664 -357 -778 -695 -509 -1083 -159 -177 352 105 -357 -307 -390 212 520 509 -208 -52 591 622 759 936 190 919 546 358 -298 -180 -175 30 591 691 227 326 -243 -1355 -950 -16 -250 -318 -322 -700 -626 -482 -672 -545 -378 -1126 -27 -398 11 652 1038 513 986 436 558 728 344 451 640 891 1268 1584 897 -589 -623 93 83 468 914 4 391 -190 72 -21 -72 -237 -954 -427 -555 -1416 -1414 -2031 -1590 -830 -721 -233 -88 298 303 116 -120 93 251 574 817 422 422 37 -376 -517 -547 -370 161 -55 -1128 -756 -272 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