File name: Pandora257s1_AustinTX_20250529_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250530T063605.3Z 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_20250529_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: 20250529 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 20250529T150334.7Z 9280.627485 172 1 54.58 2 46.46 87.87 76.75 66.11 0.00 1 0.00 1 0 17 2.631e-02 1.182e-02 6.001e-03 2.853e-03 1.814811e-01 1.585310e-03 1.958385e-03 -6.000000e+00 1.691283e-02 230.95 -2.00 3.25 -2.00 316.44 0.00e+00 7.173481e-06 1.939226e-04 3.718560e-05 -6.000000e+00 7.800420e-04 290.02 -2.00 20.00 -2.00 315.60 0.00e+00 1.449 0.000 302.00 328.00 3 6.5621e+00 4.1566e-03 1.6601e-02 -6.0000e+00 4.2158e-02 -2.4026e-03 4.6423e-03 8.6381e-03 -6.0000e+00 4.5450e-02 3.3438e-02 2.6502e-03 4.1623e-03 -6.0000e+00 2.7141e-02 -1.4877e-02 1.1785e-03 1.1396e-03 -6.0000e+00 1.1224e-02 1.5051e-04 8.7522e-04 1.0276e-04 1.7561e-05 -6.0000e+00 9.5125e-04 2.5445e-02 2.1257e-05 12 8 8 10 0 0 99.99 28.04 0.31 0.02544 0.03202 85 8 1 5 0 642.090 36.00 20.00 28.04 31.31 0.0 970.74 -5401 -3169 -1671 2953 -13011 -8225 -7294 -2422 3040 -4563 2926 -2586 -3021 7314 4947 -2883 879 6979 1438 1944 7023 -444 7038 3366 2270 -2491 -3267 1212 -1945 1553 -38 1740 -2626 279 -5247 7140 -4839 -871 -890 718 -497 -509 2101 -2214 -1003 -2605 -3287 2197 -872 225 1246 3532 376 3137 -1072 -146 409 545 -67 254 -167 891 3703 -1039 -1725 -1354 1399 703 -915 1724 -52 1453 -804 201 1449 1122 1047 -2828 -214 -1004 -2161 -1109 -2814 -1195 -89 -227 23 557 1115 873 -911 -210 -461 168 32 1501 404 445 -6 -1351 219 -969 465 -229 -22 -1078 -630 435 7 1363 495 461 81 467 -828 -268 -202 -610 332 -280 160 -222 -777 2029 -336 88 247 10 970 -316 -397 -590 565 53 -386 44 -586 657 1225 802 -644 -928 -781 -1053 -629 -323 518 -2534 -1508 -1390 -475 602 -1009 615 -601 -765 1839 1387 -929 284 2188 490 674 2348 -162 2438 1254 883 -1026 -1328 450 -715 543 -14 649 -1055 109 -2149 2650 -2216 -439 -517 419 -317 -340 1397 -1547 -690 -1796 -2227 1372 -552 142 804 2336 268 2264 -828 -113 320 424 -52 200 -137 762 3240 -977 -1599 -1181 1123 562 -780 1552 -51 1457 -824 197 1312 934 805 -2176 -165 -846 -2023 -1116 -3077 -1364 -98 -266 29 697 1380 1043 -1035 -237 -486 171 34 1677 497 541 -7 -1714 262 -1209 557 -283 -27 -1374 -839 599 10 2029 764 711 121 649 -1082 -361 -270 -773 441 -396 232 -323 -1110 2709 -437 118 320 12 1288 -446 -534 -818 793 77 -592 71 -972 1098 2047 1326 -1053 -1483 -1233 SS 20250529T152332.7Z 9280.641351 187 1 16.66 2 42.15 90.31 72.94 68.08 0.00 1 0.00 1 0 17 8.271e-03 6.334e-03 2.031e-03 1.395e-03 1.765092e-01 7.897509e-04 1.954988e-03 -6.000000e+00 5.314566e-03 230.95 -2.00 3.25 -2.00 314.97 0.00e+00 3.168567e-04 7.073122e-05 1.923065e-05 -6.000000e+00 2.452456e-04 290.02 -2.00 20.00 -2.00 314.26 0.00e+00 1.347 0.000 302.00 328.00 3 4.6181e+00 2.0336e-03 1.5670e-02 -6.0000e+00 1.3247e-02 2.2293e-02 2.2474e-03 8.4592e-03 -6.0000e+00 1.4284e-02 6.7826e-03 1.2812e-03 4.0895e-03 -6.0000e+00 8.5294e-03 -5.8206e-03 5.4382e-04 1.1369e-03 -6.0000e+00 3.5255e-03 1.1700e-03 3.4699e-04 4.9726e-05 1.9551e-05 -6.0000e+00 2.9906e-04 2.7019e-02 -3.9298e-05 12 1 1 12 1 1 98.71 28.09 0.44 0.02702 0.02963 16 5 1 5 0 979.380 36.00 20.00 28.09 32.56 0.0 980.54 -419 -1952 -1935 -1884 -3106 -741 -194 729 795 -940 -853 77 292 776 1156 -353 -112 675 551 1046 1994 621 1530 1154 285 72 -228 -604 110 1452 1435 1099 497 -760 -2301 -82 -1133 -731 -510 -496 -1092 -846 -623 -1001 -793 -554 -866 -289 -528 -33 1019 1144 247 1267 289 419 599 573 367 798 1335 1715 1513 629 -408 -418 26 58 785 998 133 214 20 95 -119 -114 -262 -619 -278 -359 -1257 -1548 -2073 -1605 -852 -840 -439 -8 203 245 47 197 25 430 906 878 459 276 139 -450 -360 -609 -193 -97 -45 -807 -377 -293 -293 412 388 178 -27 218 -42 14 387 117 253 175 -256 -220 325 364 452 752 319 470 954 306 86 -366 -172 -97 270 131 -301 449 105 -200 -446 -514 -743 -139 -680 -664 -612 -963 -221 -60 241 278 -345 -319 30 113 327 528 -161 -53 325 273 526 1005 320 797 624 160 41 -127 -321 55 712 719 575 270 -417 -1268 -45 -643 -473 -355 -364 -868 -700 -496 -805 -633 -461 -704 -227 -408 -26 804 945 203 1069 252 371 533 508 325 712 1226 1568 1458 626 -402 -387 24 53 742 965 132 220 20 94 -117 -108 -229 -553 -240 -336 -1235 -1573 -2259 -1758 -986 -985 -537 -10 252 292 55 222 27 459 943 984 537 332 174 -560 -427 -718 -220 -113 -55 -1012 -473 -383 -401 560 543 249 -37 286 -54 16 483 144 330 231 -350 -301 433 486 573 949 390 572 1194 385 112 -496 -228 -133 385 188 -446 675 153 -300 -653 -734 -1051 SS 20250529T152743.6Z 9280.644255 190 1 54.69 2 41.24 90.85 72.13 68.48 0.00 1 0.00 1 0 17 1.779e-02 1.003e-02 4.255e-03 2.336e-03 1.710430e-01 1.300739e-03 1.877782e-03 -6.000000e+00 1.143304e-02 230.95 -2.00 3.25 -2.00 315.84 0.00e+00 2.274079e-04 1.410082e-04 3.919203e-05 -6.000000e+00 5.274549e-04 290.02 -2.00 20.00 -2.00 315.05 0.00e+00 1.328 0.000 302.00 328.00 3 6.4661e+00 3.3825e-03 1.5372e-02 -6.0000e+00 2.8498e-02 1.6033e-02 3.7647e-03 8.2068e-03 -6.0000e+00 3.0726e-02 2.2170e-02 2.1381e-03 3.9608e-03 -6.0000e+00 1.8348e-02 -1.1067e-02 9.3624e-04 1.1031e-03 -6.0000e+00 7.5858e-03 1.8918e-04 7.3965e-04 8.3399e-05 1.7807e-05 -6.0000e+00 6.4320e-04 2.6238e-02 -8.7755e-06 12 9 8 11 40 0 99.97 28.11 0.98 0.02624 0.03180 29 3 1 5 0 1885.790 36.00 20.00 28.11 33.00 0.0 983.63 -801 -3050 -1159 5664 -7883 -2239 -3218 -1372 1781 -2123 1099 -2389 539 5166 2704 -2025 678 6486 -1304 388 -195 -450 4535 3054 1737 -1760 -1549 -60 -1860 1060 407 575 -2547 -1187 -4244 5369 -3798 -771 -869 -345 202 -349 566 -1380 -954 -1958 -2557 1287 -468 294 1285 3205 445 2771 -7 -363 30 -227 397 340 350 778 2719 159 -1335 -895 1019 212 -306 1003 375 1198 -140 281 189 694 494 -2578 -415 -844 -1858 -1125 -2726 -1115 78 -319 -58 449 939 987 -337 -559 234 -594 413 1421 817 353 -880 -801 80 -677 198 386 172 -1243 -790 277 -32 1243 691 4 65 457 -187 -287 -543 -639 -200 -334 281 -453 -297 1597 -277 250 625 -510 698 -247 -459 188 656 328 -173 -101 -334 670 1160 629 -1053 -1276 -370 -185 -747 -274 1187 -1787 -472 -717 -323 432 -552 282 -664 157 1579 920 -765 259 2402 -535 160 -82 -191 1872 1323 785 -830 -712 -26 -783 426 168 247 -1160 -533 -1943 2287 -1938 -436 -515 -228 143 -259 426 -1064 -729 -1489 -1906 897 -325 204 911 2333 348 2193 -6 -309 25 -194 335 291 309 723 2603 146 -1219 -837 883 183 -278 973 360 1179 -140 269 185 619 407 -2106 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