File name: Pandora257s1_AustinTX_20250716_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250717T065521.8Z 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_20250716_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: 20250716 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 20250716T131145.3Z 9328.549830 234 1 2.25 2 72.33 75.24 40.31 233.13 0.00 1 0.00 1 0 17 4.205e-02 7.312e-03 1.318e-02 2.513e-03 4.070593e-01 1.387267e-03 4.390885e-03 -6.000000e+00 2.692467e-02 230.14 -2.00 3.25 -2.00 318.12 0.00e+00 9.671979e-04 2.686692e-04 2.883488e-04 -6.000000e+00 1.263162e-03 293.13 -2.00 20.00 -2.00 317.19 0.00e+00 3.248 0.000 302.00 328.00 3 1.6850e+00 3.7560e-03 3.7246e-02 -6.0000e+00 6.6903e-02 1.1474e-02 4.2659e-03 1.9560e-02 -6.0000e+00 7.2152e-02 -1.9586e-02 2.6490e-03 9.4740e-03 -6.0000e+00 4.3201e-02 4.0886e-03 1.3185e-03 2.6899e-03 -6.0000e+00 1.7939e-02 2.5494e-03 -1.6939e-04 8.6760e-05 3.8187e-05 -6.0000e+00 1.5202e-03 2.9140e-02 -9.2690e-05 12 9 1 12 1 1 92.47 28.42 0.31 0.02914 0.02787 15 38 1 5 0 140.400 36.25 20.00 28.42 32.41 0.0 976.90 -15404 -13844 -13969 -17189 -18133 -15745 -15728 -9978 -6535 -13283 -10164 -6789 -3905 -108 -903 -2925 724 5214 -36 610 4452 -1017 2060 720 616 -1237 -2328 -4198 -2475 836 1037 1054 409 -450 -2234 -303 -1174 -1450 -1276 1194 302 -958 675 -868 -776 -146 -946 39 -235 757 880 2227 1130 1887 1070 1400 1336 468 1370 1324 624 2280 1569 1218 141 -394 640 597 376 1097 500 418 -256 289 67 -1038 32 -941 -732 -997 -1523 -1481 -2155 -2147 -952 -694 -565 97 260 397 274 523 120 -10 641 240 99 428 -51 -527 -760 -853 -658 35 -343 -1104 -881 -384 -35 456 371 -402 -84 188 8 172 953 524 351 337 -121 -282 621 740 423 642 435 848 1338 346 172 -124 -240 -384 140 -156 -201 373 262 -473 -204 -744 -701 -849 -814 -839 -1040 -1075 -922 -987 -650 -448 -1042 -829 -597 -387 -11 -106 -393 102 749 -6 100 726 -180 369 138 124 -261 -496 -895 -518 176 217 243 102 -116 -593 -82 -357 -476 -490 474 133 -424 304 -405 -366 -69 -449 18 -114 380 472 1191 655 1082 646 868 841 297 859 840 417 1518 1135 884 105 -287 476 431 291 881 435 360 -221 249 54 -818 24 -695 -577 -837 -1377 -1414 -2145 -2284 -1023 -758 -645 113 300 441 298 554 122 -10 668 267 118 538 -66 -676 -966 -1058 -781 42 -432 -1429 -1160 -534 -50 672 559 -626 -128 282 11 243 1329 760 518 502 -183 -424 931 1066 605 911 605 1199 1933 525 270 -198 -389 -652 242 -275 -366 688 482 -857 -366 -1295 -1202 SS 20250716T131623.3Z 9328.553048 237 1 10.09 2 71.36 75.74 41.09 234.40 0.00 1 0.00 1 0 25 2.924e-02 6.015e-03 6.574e-03 1.316e-03 3.922182e-01 7.266196e-04 4.230011e-03 -6.000000e+00 1.873098e-02 230.14 -2.00 3.25 -2.00 317.99 0.00e+00 5.232566e-04 1.360696e-04 2.619594e-04 -6.000000e+00 8.782331e-04 293.13 -2.00 20.00 -2.00 317.05 0.00e+00 3.089 0.000 302.00 328.00 3 2.0853e+00 1.9633e-03 3.5560e-02 -6.0000e+00 4.6544e-02 1.8120e-02 2.2265e-03 1.8836e-02 -6.0000e+00 5.0188e-02 -1.6966e-02 1.3709e-03 9.0982e-03 -6.0000e+00 3.0050e-02 3.1306e-03 6.7961e-04 2.5133e-03 -6.0000e+00 1.2484e-02 2.0108e-03 2.9618e-04 4.5633e-05 3.5965e-05 -6.0000e+00 1.0570e-03 2.8120e-02 -1.4710e-06 12 1 1 12 1 1 99.98 28.41 0.28 0.02812 0.03035 61 32 1 5 0 162.710 36.25 20.00 28.41 32.64 0.0 979.04 -9572 -11010 -12092 -13484 -12970 -11549 -1972 -1975 -9397 -7650 -5113 -3924 -3202 -1240 -575 -3076 -1789 2038 -154 2568 1681 -122 3271 316 497 -2237 -1112 -856 -1761 -156 741 -436 79 -993 -3292 -389 -1922 -660 -237 412 -32 -260 71 -868 -14 -206 -147 326 -43 486 1261 1643 910 1605 303 677 955 648 645 763 1250 1816 1741 1441 -46 -153 403 70 410 1126 278 234 -68 6 -98 -177 -486 -1077 -570 -772 -1410 -1397 -2040 -1544 -1140 -719 -208 -136 319 383 162 330 -25 100 785 388 331 335 100 -396 -600 -795 -490 -55 -89 -1001 -767 -529 -127 282 373 155 -16 114 -80 185 528 337 448 256 -301 130 547 600 283 643 83 652 910 252 156 -47 -274 -212 205 10 -163 115 156 -331 -302 -452 -559 -552 -695 -785 -865 -802 -712 -118 -130 -727 -621 -432 -364 -339 -150 -72 -439 -273 319 -26 437 296 -22 607 64 105 -500 -245 -184 -380 -34 175 -104 20 -263 -899 -107 -598 -218 -91 167 -14 -124 35 -437 -7 -104 -74 165 -21 242 667 931 521 966 193 441 631 429 425 508 812 1259 1228 1073 -35 -114 291 52 323 916 246 203 -59 5 -80 -141 -363 -805 -452 -648 -1270 -1324 -2106 -1617 -1213 -809 -244 -156 363 438 174 346 -27 105 836 438 399 425 128 -508 -765 -994 -587 -67 -109 -1304 -1012 -739 -181 413 557 237 -24 170 -116 257 729 483 650 387 -466 199 809 885 400 904 115 910 1296 374 238 -75 -443 -359 352 18 -293 211 285 -593 -523 -780 -953 SS 20250716T132011.7Z 9328.555691 240 1 55.23 2 70.56 76.15 41.73 235.41 0.00 1 0.00 1 0 17 4.975e-01 4.013e-02 1.832e-01 8.714e-03 3.073934e-01 4.821004e-03 3.184031e-03 -6.000000e+00 3.207689e-01 230.14 -2.00 3.25 -2.00 319.18 0.00e+00 5.890096e-03 1.347560e-03 5.340528e-04 -6.000000e+00 1.572767e-02 293.13 -2.00 20.00 -2.00 318.29 0.00e+00 2.971 0.000 302.00 328.00 3 6.4527e+00 1.3783e-02 3.2400e-02 -6.0000e+00 7.9766e-01 -1.4474e-02 1.6298e-02 1.5328e-02 -6.0000e+00 8.6110e-01 5.9550e-02 1.1514e-02 9.5696e-03 -6.0000e+00 5.1477e-01 -2.7864e-02 5.8692e-03 7.1059e-03 -6.0000e+00 2.1465e-01 3.1294e-05 4.8226e-03 3.2239e-04 7.6951e-05 -6.0000e+00 1.8160e-02 2.3491e-02 4.8192e-04 12 9 8 11 8 0 99.99 28.41 1.09 0.02349 0.05973 21 2 1 5 0 2629.550 36.25 20.00 28.41 32.84 0.0 980.03 40065 18133 900000 900000 -81686 -21549 -12840 15550 59796 -20852 326572 -15925 29290 216508 900000 -4955 30017 203496 57206 178256 900000 1811 239997 33356 67341 -29311 -14691 52540 -9091 17523 14474 16559 -17977 25285 -13328 900000 -31812 926 -4785 6867 59260 11601 18792 -13093 -1050 -9683 -11046 20410 10010 9859 18335 30311 1194 17466 -4411 -1723 -9641 -482 1693 1574 -6972 -606 19106 -1560 -11832 -379 13481 5777 -3809 3896 -1329 4748 -3741 -532 -1112 5097 6514 -17459 -764 2047 -4962 1841 -8738 -2121 3139 -2063 1112 1821 2743 2356 -6955 -3936 3844 -965 -432 7376 3686 -907 -3073 244 670 -2220 5239 1126 2792 -1764 516 1405 241 4717 -155 -1758 -807 4003 638 -635 70 -1868 -832 -2595 502 -3901 1354 7268 -4042 101 979 -632 1316 -2743 -2576 -2805 3103 917 -2020 -646 -1073 1966 3846 4209 -2016 -4320 1320 804 490 900000 900000 -5675 -815 -466 456 1200 -982 2773 -836 1130 1838 900000 -402 1854 2356 3003 3178 900000 178 2445 2775 4117 -4778 -2058 3703 -1189 1830 1684 2053 -3343 3113 -2422 900000 -7968 193 -1219 1755 9761 3260 5106 -5014 -362 -3667 -4239 5719 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