File name: Pandora257s1_AustinTX_20241012_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20241013T062539.8Z 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 v1.8.60 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20241012_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: 20241012 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 20241012T131130.2Z 9051.549655 72 1 54.93 2 82.37 103.57 164.98 302.19 0.00 1 0.00 1 0 17 6.603e-01 2.697e-02 2.751e-01 5.917e-03 6.944840e-01 3.613469e-03 1.036487e-02 -6.000000e+00 4.285100e-01 226.95 -2.00 3.25 -2.00 321.68 0.00e+00 2.918614e-02 2.220086e-03 1.015166e-02 -6.000000e+00 2.272448e-02 290.19 -2.00 20.00 -2.00 321.08 0.00e+00 6.994 0.004 302.00 328.00 3 1.9024e+00 1.4643e-02 8.2998e-02 -6.0000e+00 1.0715e+00 6.5462e-01 1.9514e-02 4.7140e-02 -6.0000e+00 1.1721e+00 -8.1730e-01 1.6566e-02 3.8071e-02 -6.0000e+00 6.9204e-01 3.1205e-01 7.5949e-03 2.2178e-02 -6.0000e+00 2.8339e-01 4.0137e-05 -1.0071e-03 2.0247e-04 5.7122e-04 -6.0000e+00 2.4238e-02 2.8403e-02 -4.5949e-06 12 8 8 10 0 0 21.10 27.53 0.79 0.02840 0.02084 56 5 1 5 0 980.720 35.75 20.00 27.53 24.88 0.0 926.75 -13540 900000 58969 900000 -200678 -132144 -105681 237830 900000 -145358 900000 -105006 106922 900000 900000 87109 261315 900000 900000 900000 900000 93966 900000 900000 96118 -81797 -50606 64247 50365 107322 19380 900000 -10613 900000 27203 -27517 -31769 32084 59458 68876 187996 165572 133584 -9344 15659 9339 -15016 284273 57025 70218 55606 172809 30299 95543 3501 17245 9907 53958 51 17257 4066 21815 61022 3049 -7650 13776 47037 22744 -1056 22122 -895 16117 -5376 -769 7549 8877 4132 -8366 2325 1681 -2115 -5461 -6450 -638 6624 -474 -1610 -381 2200 -2903 -9111 -4638 -2386 -6890 -1588 3607 3585 946 -1792 -3556 414 -2778 4498 -445 -418 -5181 -2412 -531 -1059 1876 -1268 597 -1082 1748 -906 -330 -192 -61 -1426 -233 1183 44 2119 5933 -601 801 1708 -57 1913 -973 -427 -341 2065 382 -909 -191 -780 460 754 517 -518 -1131 -931 -113 900000 339 900000 -10917 -3249 -1824 1368 900000 -3345 900000 -2087 615 900000 900000 683 1504 900000 900000 900000 900000 836 900000 900000 704 -3423 -1535 639 695 988 524 900000 -513 900000 923 -1615 -2047 1200 1882 2180 1947 2286 2690 -828 1135 758 -1633 1636 3380 3919 3903 4077 3173 5442 510 2183 1328 4564 7 2145 620 3113 6636 653 -1919 2830 7010 4502 -287 5219 -284 4405 -1779 -228 1894 2028 958 -2306 653 558 -848 -2558 -3336 -333 3411 -276 -991 -237 1331 -1792 -5683 -2634 -1305 -4139 -1015 2546 2681 825 -1735 -3543 379 -2427 3763 -387 -344 -4743 -2304 -542 -1205 2315 -1776 870 -1629 2511 -1294 -459 -270 -89 -2224 -370 1854 68 3104 8078 -843 1079 2275 -81 2968 -1743 -771 -666 4196 839 -2149 -470 -1838 1088 1769 1276 -1230 -2573 -2063 SS 20241012T132852.5Z 9051.561719 77 1 54.81 2 78.75 105.92 167.76 313.47 0.00 1 0.00 1 0 25 1.984e-01 6.538e-03 2.443e-02 1.044e-03 5.547845e-01 5.787587e-04 5.903457e-03 -6.000000e+00 1.255870e-01 226.95 -2.00 3.25 -2.00 319.97 0.00e+00 1.081709e-03 2.059929e-04 8.730301e-04 -6.000000e+00 5.887141e-03 290.19 -2.00 20.00 -2.00 319.20 0.00e+00 4.946 0.001 302.00 328.00 3 1.3599e+00 1.7418e-03 5.4969e-02 -6.0000e+00 3.1000e-01 -2.6391e-03 2.1363e-03 2.7071e-02 -6.0000e+00 3.3523e-01 -3.6262e-02 1.7450e-03 1.3498e-02 -6.0000e+00 2.0088e-01 6.1376e-03 8.8063e-04 3.9858e-03 -6.0000e+00 8.3682e-02 6.4115e-04 -1.2288e-04 3.4586e-05 6.1731e-05 -6.0000e+00 7.1642e-03 2.8553e-02 -5.6749e-05 11 8 0 10 0 0 8.11 27.50 0.36 0.02855 0.02763 321 31 1 5 0 170.720 35.50 20.00 27.50 26.13 0.0 936.37 -44727 -69531 -48234 -60168 -102967 -87080 -70629 -60681 -46743 -68100 -41447 -53580 -22889 293 3498 -16255 -6598 2569 4814 -4387 -2911 -6403 6071 -544 -9977 -18400 -14277 -15542 -8301 -5810 -6328 -5660 -6077 -4400 -10787 7061 -8816 -1008 -2560 2362 -1525 988 2317 -2035 -341 -1370 -623 3304 257 1554 1371 4359 2029 4183 -269 1387 1683 1635 26 561 560 1631 3161 1455 403 -42 1654 982 417 1571 507 707 222 -91 -86 -1174 -190 -1640 -921 -1115 -1393 -1650 -1974 -1535 -460 -316 128 371 550 634 10 262 -101 47 443 583 238 505 -61 -672 -467 -654 -610 51 -322 -1205 -868 -328 -201 443 325 131 94 235 25 136 382 240 186 38 -127 -267 485 478 190 401 134 531 756 39 -61 -287 -298 -157 -31 -25 -145 290 223 -218 -160 -133 -299 -405 -899 -526 -735 -1909 -1419 -1065 -927 -690 -1366 -709 -1206 -459 6 79 -515 -212 82 162 -170 -116 -274 243 -25 -540 -1126 -849 -939 -479 -354 -439 -443 -526 -393 -1051 607 -998 -125 -382 388 -264 179 435 -410 -69 -285 -131 692 58 372 360 1223 635 1378 -98 517 639 623 10 218 209 656 1376 694 201 -21 817 510 237 904 319 461 144 -57 -50 -688 -105 -940 -531 -736 -979 -1305 -1712 -1330 -422 -307 129 360 530 629 10 234 -88 42 432 602 264 619 -75 -835 -586 -767 -723 60 -378 -1511 -1090 -439 -277 662 497 209 151 363 39 205 575 376 290 61 -207 -428 748 749 286 584 193 791 1221 66 -107 -512 -562 -298 -63 -51 -304 613 471 -450 -330 -263 -582 SS 20241012T133418.4Z 9051.565490 80 1 54.75 2 77.62 106.68 168.53 317.98 0.00 1 0.00 1 0 25 1.410e-01 6.306e-03 1.177e-02 7.598e-04 5.137900e-01 4.177247e-04 5.506512e-03 -6.000000e+00 8.922223e-02 226.95 -2.00 3.25 -2.00 319.51 0.00e+00 1.277033e-03 1.256379e-04 6.563381e-04 -6.000000e+00 4.182847e-03 290.19 -2.00 20.00 -2.00 318.69 0.00e+00 4.530 0.001 302.00 328.00 3 1.2168e+00 1.2043e-03 5.0413e-02 -6.0000e+00 2.2023e-01 -9.6552e-04 1.4294e-03 2.4799e-02 -6.0000e+00 2.3817e-01 -3.3784e-02 1.0827e-03 1.2295e-02 -6.0000e+00 1.4271e-01 6.0052e-03 5.5588e-04 3.6899e-03 -6.0000e+00 5.9448e-02 1.1289e-03 -1.8794e-04 2.5471e-05 5.4277e-05 -6.0000e+00 5.0902e-03 2.8601e-02 -7.5521e-05 10 0 0 10 0 0 38.85 27.51 0.35 0.02860 0.02719 434 42 1 5 0 126.140 35.50 20.00 27.51 26.43 0.0 938.43 -45381 -33502 -60298 -50921 -58842 -58894 -52900 -39096 -28480 -45899 -19030 -40831 -23901 -7715 -7017 -11138 -6629 -2940 751 -1730 -852 -6904 2023 -3823 -4988 -9070 -7341 -7682 -7336 -2233 -5724 -3571 -2942 -1774 -6540 1667 -4189 -1578 -772 149 -652 397 1423 -295 650 596 204 1531 352 1225 1678 2800 1890 2968 1063 996 1249 1155 147 470 989 1529 2513 1502 266 19 826 572 534 1364 481 514 476 -85 -182 -528 -514 -1563 -797 -918 -1499 -1403 -1947 -1610 -702 -416 26 219 472 306 -10 356 -54 171 511 262 143 318 7 -588 -485 -699 -601 -153 -384 -1188 -882 -346 -110 435 310 164 49 256 4 185 462 309 242 54 -319 -18 418 482 368 468 181 651 890 89 14 -122 -235 -121 18 -59 -162 187 168 -272 -242 -203 -378 -743 -539 -1314 -1000 -1230 -1261 -1156 -828 -599 -1252 -437 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