File name: Pandora257s1_AustinTX_20240610_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240611T063623.3Z 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 v1.8.59 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20240610_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: 20240610 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 20240610T134200.1Z 8927.570834 110 1 53.38 2 63.84 77.34 107.27 51.17 0.00 1 0.00 1 0 17 7.232e-02 1.610e-02 1.569e-02 3.354e-03 2.678029e-01 1.839869e-03 2.891263e-03 -6.000000e+00 4.651549e-02 230.97 -2.00 3.25 -2.00 318.10 0.00e+00 2.516258e-04 3.484263e-04 1.732360e-04 -6.000000e+00 2.153726e-03 291.11 -2.00 20.00 -2.00 317.20 0.00e+00 2.255 0.000 302.00 328.00 3 5.9703e+00 4.9781e-03 2.5544e-02 -6.0000e+00 1.1591e-01 -4.2636e-02 5.6521e-03 1.3077e-02 -6.0000e+00 1.2491e-01 5.3369e-02 3.4744e-03 6.2318e-03 -6.0000e+00 7.4646e-02 -2.5988e-02 1.7036e-03 1.8100e-03 -6.0000e+00 3.0921e-02 1.1007e-04 1.5919e-03 1.2097e-04 2.5891e-05 -6.0000e+00 2.6149e-03 2.4372e-02 1.1276e-04 12 8 8 10 0 0 99.97 28.41 0.65 0.02437 0.03633 17 2 1 5 0 3139.960 36.25 19.99 28.41 33.38 0.0 995.44 7944 -11708 -11209 41101 -17936 -23806 -8714 -15558 3332 -11216 1691 -14813 1746 21087 8166 -7076 6553 14199 6998 2381 34539 -3377 17759 -119 1700 -12868 -3433 6351 -10152 -1979 4778 -1275 -8583 307 -9449 10560 -12755 -2248 -923 473 4276 2203 1751 -1044 -601 -3559 -3202 2923 -347 1578 3800 7112 482 3340 -1404 352 -1179 289 1736 -440 -862 68 5642 -140 -3597 -3462 3588 437 455 1830 -827 2271 -833 1748 506 594 2403 -5452 -803 -1079 -2530 -876 -4648 -1648 838 -961 271 1577 666 693 -1162 -992 1282 37 866 2410 758 664 -1237 -279 -196 -1812 1207 203 906 -1516 -1796 513 443 1597 780 11 -391 1155 -396 -296 -467 -936 -106 -738 27 -1660 850 2096 -1140 912 165 402 1034 -1071 -116 87 474 354 -382 17 -75 -49 1323 1047 -902 -1198 -565 488 -930 -891 1868 -1414 -1993 -667 -1394 267 -1093 152 -1686 188 2117 1042 -1143 982 2066 1140 420 4518 -659 2904 -24 357 -3190 -766 1244 -2288 -415 983 -297 -2262 75 -2553 2418 -4071 -747 -352 201 1909 963 792 -492 -283 -1717 -1520 1419 -174 794 1962 3775 263 1856 -847 214 -735 178 1050 -275 -564 47 3917 -106 -2816 -2592 2404 303 335 1448 -722 1994 -754 1484 407 438 1619 -3885 -572 -846 -2231 -832 -4926 -1654 875 -1086 317 1867 792 794 -1270 -1094 1299 38 910 2717 877 834 -1651 -366 -245 -2172 1361 236 1105 -2003 -2506 735 670 2326 1191 17 -591 1757 -571 -407 -641 -1335 -158 -1166 43 -2492 1317 3086 -1653 1239 219 537 1436 -1608 -181 140 788 566 -646 30 -137 -92 2434 1896 -1618 -2095 -970 SS 20240610T134646.9Z 8927.574154 113 1 55.17 2 62.84 77.83 106.50 51.94 0.00 1 0.00 1 0 17 1.719e-02 6.719e-03 3.130e-03 1.096e-03 2.763362e-01 6.078618e-04 3.005786e-03 -6.000000e+00 1.104935e-02 230.97 -2.00 3.25 -2.00 317.07 0.00e+00 1.193000e-04 8.777217e-05 7.964683e-05 -6.000000e+00 5.119940e-04 291.11 -2.00 20.00 -2.00 316.19 0.00e+00 2.178 0.000 302.00 328.00 3 4.3449e+00 1.6091e-03 2.5097e-02 -6.0000e+00 2.7533e-02 -8.9281e-03 1.8023e-03 1.3287e-02 -6.0000e+00 2.9678e-02 8.9787e-03 1.0496e-03 6.4039e-03 -6.0000e+00 1.7734e-02 -7.7548e-03 4.8976e-04 1.7414e-03 -6.0000e+00 7.3414e-03 5.9087e-04 4.2273e-04 3.8967e-05 2.6209e-05 -6.0000e+00 6.2156e-04 2.5684e-02 -1.2266e-05 11 8 0 10 0 0 99.97 28.41 0.28 0.02568 0.02886 58 6 1 5 0 951.040 36.25 20.00 28.41 33.61 0.0 996.90 -1527 -5552 -6254 -728 -8232 -6937 -2965 -4051 -887 -4021 -1506 -950 -623 3265 1392 -2250 340 1897 1964 740 5415 -369 4535 1436 563 -1447 -696 -497 -1878 495 2183 -356 -308 -872 -3750 604 -3452 -760 -402 86 -584 -427 374 -1185 -576 -587 -849 311 -211 411 1460 1772 828 1577 208 385 816 525 517 579 763 1190 1898 866 -583 -902 726 268 387 902 201 509 -4 395 128 -117 78 -1414 -312 -582 -1495 -1472 -2241 -1689 -803 -674 -126 183 330 281 -160 5 187 354 803 827 39 599 -118 -512 -546 -759 -294 246 96 -1051 -906 -235 -145 649 444 114 99 157 -176 105 190 153 342 37 -269 -463 497 761 124 647 318 626 1009 65 55 -3 -196 20 77 40 -226 130 449 -195 -320 -538 -684 -177 -708 -805 -85 -996 -826 -360 -541 -124 -607 -232 -156 -113 646 284 -518 81 465 499 196 1400 -103 1245 425 175 -468 -220 -152 -567 147 668 -119 -108 -312 -1380 220 -1320 -326 -200 44 -331 -255 227 -741 -358 -363 -519 186 -126 250 922 1185 549 1087 150 284 607 392 385 435 594 915 1542 737 -500 -743 566 210 321 811 183 481 -4 359 116 -98 65 -1164 -266 -509 -1372 -1480 -2296 -1832 -920 -774 -151 224 401 329 -188 5 202 375 835 937 46 768 -151 -652 -701 -921 -344 292 121 -1333 -1209 -328 -202 949 678 167 149 223 -246 140 251 209 492 53 -399 -685 712 1099 172 854 431 851 1356 94 79 -4 -301 31 123 67 -375 218 756 -324 -541 -886 -1115 SS 20240610T135153.8Z 8927.577706 116 1 54.73 2 61.75 78.36 105.67 52.75 0.00 1 0.00 1 0 17 1.030e-02 5.927e-03 1.065e-03 4.999e-04 2.686229e-01 2.785005e-04 2.938779e-03 -6.000000e+00 6.617425e-03 230.97 -2.00 3.25 -2.00 316.41 0.00e+00 2.980638e-04 3.404564e-05 7.873807e-05 -6.000000e+00 3.067064e-04 291.11 -2.00 20.00 -2.00 315.56 0.00e+00 2.102 0.000 302.00 328.00 3 2.9996e+00 7.2865e-04 2.4257e-02 -6.0000e+00 1.6489e-02 -7.9182e-03 8.1180e-04 1.2870e-02 -6.0000e+00 1.7775e-02 -1.0550e-03 4.6402e-04 6.2113e-03 -6.0000e+00 1.0622e-02 -2.9297e-03 2.0879e-04 1.6956e-03 -6.0000e+00 4.3959e-03 2.4729e-03 1.2847e-04 1.7729e-05 2.6547e-05 -6.0000e+00 3.7234e-04 2.6120e-02 -5.2069e-05 10 0 0 10 0 0 98.66 28.41 0.31 0.02612 0.02709 223 22 1 5 0 245.380 36.25 20.00 28.41 33.88 0.0 999.48 -1723 -2274 -3764 -3669 -4068 -2949 -1791 -816 -280 -2367 -1990 -1324 -597 933 246 -588 183 889 1360 1349 1798 181 1801 1177 589 100 -302 -410 -169 1048 1299 341 579 -929 -2604 -882 -1114 -261 -164 -212 -848 -703 -328 -735 -165 -278 -410 -85 -292 397 1119 1260 884 1150 450 658 787 456 501 769 912 1492 1396 1153 -59 -730 73 3 667 949 194 35 -166 107 -30 -283 -211 -824 -177 -559 -1379 -1488 -1992 -1672 -932 -683 -352 -169 197 210 100 224 50 391 716 564 209 452 46 -521 -560 -612 -539 73 -51 -919 -730 -372 -182 400 370 218 49 136 -17 176 315 331 334 357 -21 -69 410 434 436 639 246 714 979 289 119 -98 -272 -55 133 22 -151 142 142 -480 -316 -470 -670 -303 -424 -713 -667 -709 -506 -321 -157 -58 -478 -417 -295 -147 255 69 -181 59 298 471 481 605 63 635 436 228 40 -118 -155 -62 382 494 140 248 -409 -1161 -372 -518 -130 -89 -130 -538 -469 -224 -483 -108 -191 -278 -57 -195 268 744 887 660 851 347 518 625 363 397 615 720 1244 1183 1015 -52 -621 62 2 568 878 185 35 -165 103 -28 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