File name: Pandora257s1_AustinTX_20240812_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240813T064233.5Z 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 v1.8.59 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20240812_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: 20240812 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 20240812T130315.1Z 8990.543925 70 1 15.86 2 76.88 80.44 164.70 55.92 0.00 1 0.00 1 0 17 4.025e-01 1.856e-02 2.448e-01 7.657e-03 5.108740e-01 4.399974e-03 5.581871e-03 -6.000000e+00 2.605523e-01 229.59 -2.00 3.25 -2.00 320.34 0.00e+00 2.550980e-03 1.758548e-03 1.884484e-03 -6.000000e+00 1.341262e-02 293.50 -2.00 20.00 -2.00 319.53 0.00e+00 4.292 0.001 302.00 328.00 3 4.0783e+00 1.4042e-02 4.9125e-02 -6.0000e+00 6.4784e-01 2.6556e-02 1.7734e-02 2.6847e-02 -6.0000e+00 7.0163e-01 -4.3540e-02 1.4531e-02 1.3766e-02 -6.0000e+00 4.1961e-01 1.6139e-02 7.1579e-03 4.0917e-03 -6.0000e+00 1.7351e-01 7.7735e-05 7.5644e-04 2.7267e-04 7.2725e-05 -6.0000e+00 1.4802e-02 2.8732e-02 -7.2436e-05 12 9 9 12 1 1 99.88 28.29 0.39 0.02873 0.03442 8 3 1 5 0 1761.110 36.00 20.00 28.29 32.57 0.0 985.09 -1839 -12165 900000 900000 900000 -26860 -99559 -119196 -128682 -40144 79306 -70151 50006 900000 900000 -24828 227549 900000 900000 48417 900000 320 257720 1826 71365 -60693 -37068 45268 2913 60360 21876 2921 -20171 -7029 -23640 88062 -24825 4739 -2651 11149 18129 13246 25732 -5110 471 -7164 -2383 7082 -3907 15266 23535 21302 1925 13416 -6443 742 3639 -3826 2630 313 -3163 -1593 12456 -2389 -6710 -2653 11147 -1608 -109 2066 2679 2814 232 1330 3425 -1075 4678 -8841 -871 -1672 -1465 555 -7153 -1363 1984 -583 -308 163 919 886 -3597 -2398 1747 1252 -1221 3718 -308 -23 -734 -274 771 -2063 446 -1409 -1077 -1288 39 45 897 2503 621 263 -132 1653 -693 463 -736 -556 -60 -1404 -84 -1028 596 2776 75 -369 677 -1441 1352 -31 -498 -540 319 -181 -407 77 -333 597 1003 477 -953 -72 -443 -14 -91 900000 900000 900000 -237 -1957 -3151 -4099 -571 591 -1712 485 900000 900000 -833 1697 900000 900000 1047 900000 12 1921 75 1543 -5068 -2460 1316 132 1665 995 181 -1714 -545 -2203 2823 -2758 459 -326 1372 2298 1886 3377 -937 83 -1389 -448 1241 -795 2732 4211 4256 505 3351 -2061 229 1107 -1255 806 100 -1097 -590 4383 -1042 -3127 -1177 4297 -731 -53 987 1371 1487 125 674 1736 -526 2061 -4535 -451 -901 -896 371 -5619 -1083 1627 -521 -286 154 858 798 -3196 -1985 1345 993 -1080 3520 -342 -26 -876 -324 860 -2211 486 -1580 -1158 -1469 47 57 1228 3661 989 401 -200 2571 -1051 671 -1082 -846 -95 -2162 -140 -1690 936 4103 110 -521 933 -2094 2062 -52 -839 -964 592 -355 -848 156 -695 1252 2087 968 -2030 -145 -889 SS 20240812T131223.5Z 8990.550273 73 1 38.69 2 74.93 81.52 163.12 60.54 0.00 1 0.00 1 0 25 8.232e-02 5.982e-03 1.387e-02 1.075e-03 4.739651e-01 5.939432e-04 5.064367e-03 -6.000000e+00 5.262877e-02 229.59 -2.00 3.25 -2.00 319.16 0.00e+00 5.021689e-05 1.616898e-04 3.996800e-04 -6.000000e+00 2.476443e-03 293.50 -2.00 20.00 -2.00 318.27 0.00e+00 3.771 0.001 302.00 328.00 3 2.2330e+00 1.6810e-03 4.3288e-02 -6.0000e+00 1.3058e-01 -1.1080e-02 1.9705e-03 2.2959e-02 -6.0000e+00 1.4085e-01 -7.6524e-03 1.4041e-03 1.1102e-02 -6.0000e+00 8.4396e-02 -3.6363e-03 7.2460e-04 3.0210e-03 -6.0000e+00 3.5115e-02 8.4840e-04 1.0897e-04 3.6493e-05 4.3068e-05 -6.0000e+00 2.9755e-03 2.7794e-02 -2.1636e-05 12 1 1 12 1 1 99.99 28.30 0.35 0.02779 0.02861 203 28 1 5 0 189.630 36.25 20.00 28.30 33.09 0.0 989.22 -15945 -25073 -18076 -16369 -49066 -33774 -24274 -23333 -32404 -26847 -17076 -20658 -12611 16 -1914 -2037 -2807 5119 2890 1961 2398 -2380 6473 1189 -3014 -8610 -6510 -2792 -5082 -302 -1533 -2610 -2968 -973 -4656 2411 -4921 -1668 -1350 1137 -838 220 2499 -1056 275 -886 -492 1173 -286 646 1276 2254 1231 2398 -101 804 811 366 547 353 1046 1493 2315 1147 3 -596 949 -223 488 1315 430 733 -67 252 88 -223 -293 -1395 -530 -773 -1484 -1504 -2101 -1522 -409 -301 -224 300 505 611 -15 431 155 170 528 588 192 625 -11 -553 -510 -739 -411 -130 -24 -1355 -770 -464 -113 373 362 166 199 96 -49 308 120 240 284 -66 -104 -158 341 489 178 354 84 620 817 269 -32 -195 -310 -77 85 -63 -187 315 284 -261 -307 -229 -352 -289 -547 -379 -333 -1359 -822 -583 -619 -1040 -884 -557 -793 -526 1 -100 -121 -185 336 206 148 186 -201 527 109 -307 -961 -715 -292 -550 -33 -187 -358 -444 -148 -748 379 -930 -325 -311 294 -244 68 784 -351 91 -301 -168 401 -103 222 472 898 536 1101 -50 377 388 176 261 171 526 806 1348 719 2 -355 594 -135 318 937 312 550 -50 194 63 -147 -184 -889 -362 -597 -1220 -1291 -1974 -1523 -407 -318 -247 319 563 657 -15 438 151 169 531 660 230 777 -15 -733 -644 -925 -491 -156 -30 -1733 -1037 -631 -165 557 549 260 309 150 -73 440 172 354 440 -101 -162 -243 533 733 256 516 121 907 1219 418 -54 -331 -550 -138 159 -119 -366 625 562 -506 -573 -428 -649 SS 20240812T132158.1Z 8990.556923 76 1 54.69 2 72.89 82.64 161.38 64.62 0.00 1 0.00 1 0 25 4.854e-02 5.839e-03 4.195e-03 5.557e-04 4.246081e-01 3.064035e-04 4.585731e-03 -6.000000e+00 3.102608e-02 229.59 -2.00 3.25 -2.00 318.56 0.00e+00 3.283316e-04 6.829396e-05 3.244432e-04 -6.000000e+00 1.460159e-03 293.50 -2.00 20.00 -2.00 317.63 0.00e+00 3.347 0.000 302.00 328.00 3 1.7726e+00 8.4230e-04 3.8519e-02 -6.0000e+00 7.6982e-02 -1.0796e-02 9.6662e-04 2.0515e-02 -6.0000e+00 8.3040e-02 -1.0219e-02 6.3034e-04 9.8948e-03 -6.0000e+00 4.9755e-02 -1.1318e-03 3.2108e-04 2.6883e-03 -6.0000e+00 2.0699e-02 2.1171e-03 -4.0453e-05 1.9159e-05 3.9196e-05 -6.0000e+00 1.7544e-03 2.7873e-02 -4.9728e-05 10 0 0 10 0 0 99.92 28.30 0.28 0.02787 0.02757 683 66 1 5 0 80.060 36.25 20.00 28.30 33.83 0.0 995.47 -14904 -10548 -20259 -13577 -21310 -21466 -16802 -15180 -11892 -16725 -8734 -13497 -6829 -654 -1796 -2595 -996 511 1327 395 897 -1456 1860 307 -817 -3459 -3007 -1890 -2070 -1015 -366 -864 -613 -1704 -3563 -639 -2067 -668 -387 21 -652 -209 873 -247 518 352 -68 420 151 838 1153 1531 1065 1868 663 784 1137 761 369 701 1004 1597 1927 1283 224 -352 341 -47 583 970 342 445 -65 164 -92 -529 -654 -1038 -712 -756 -1574 -1396 -2019 -1690 -884 -604 -104 81 484 309 108 347 75 239 516 435 262 416 51 -521 -517 -692 -683 -193 -159 -1155 -702 -308 -209 382 410 244 112 164 24 141 418 232 275 189 -176 -159 369 378 395 479 216 697 956 270 48 -100 -228 -108 65 -13 -226 195 203 -291 -289 -309 -498 -527 -389 -842 -517 -855 -876 -705 -694 -576 -914 -475 -862 -474 -50 -161 -263 -109 59 160 50 117 -200 259 46 -119 -534 -462 -283 -310 -157 -61 -161 -122 -355 -766 -139 -509 -189 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