File name: Pandora25s1_HoustonTX_20241003_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20241004T061922.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20241003_L1_smca1c6d20220503p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20241003 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: Update session 4 for SO2 First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.1116 305.2524 305.3931 305.5338 305.6745 305.8152 305.9558 306.0965 306.2371 306.3777 306.5183 306.6589 306.7995 306.9401 307.0806 307.2212 307.3617 307.5022 307.6427 307.7832 307.9236 308.0641 308.2045 308.3449 308.4853 308.6257 308.7661 308.9065 309.0468 309.1872 309.3275 309.4678 309.6081 309.7484 309.8886 310.0289 310.1691 310.3093 310.4495 310.5897 310.7299 310.8701 311.0102 311.1504 311.2905 311.4306 311.5707 311.7108 311.8509 311.9909 312.1310 312.2710 312.4110 312.5510 312.6910 312.8310 312.9709 313.1109 313.2508 313.3907 313.5306 313.6705 313.8104 313.9503 314.0901 314.2300 314.3698 314.5096 314.6494 314.7892 314.9290 315.0687 315.2085 315.3482 315.4879 315.6276 315.7673 315.9070 316.0466 316.1863 316.3259 316.4656 316.6052 316.7448 316.8843 317.0239 317.1635 317.3030 317.4425 317.5821 317.7216 317.8611 318.0005 318.1400 318.2794 318.4189 318.5583 318.6977 318.8371 318.9765 319.1159 319.2552 319.3946 319.5339 319.6732 319.8125 319.9518 320.0911 320.2304 320.3696 320.5089 320.6481 320.7873 320.9265 321.0657 321.2049 321.3441 321.4832 321.6223 321.7615 321.9006 322.0397 322.1788 322.3178 322.4569 322.5960 322.7350 322.8740 323.0130 323.1520 323.2910 323.4300 323.5689 323.7079 323.8468 323.9857 324.1246 324.2635 324.4024 324.5413 324.6801 324.8190 324.9578 --------------------------------------------------------------------------------------- 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 20241003T131118.0Z 9042.549514 60 1 49.55 2 78.99 101.46 88.23 101.39 0.00 1 0.00 1 0 25 2.587e-01 6.156e-03 6.460e-02 1.487e-03 6.061606e-01 7.851289e-04 6.476940e-03 -6.000000e+00 1.487178e-01 227.53 -2.00 3.24 -2.00 320.60 0.00e+00 2.471503e-03 3.286099e-04 2.725470e-04 -6.000000e+00 6.805222e-03 292.15 -2.00 20.00 -2.00 319.87 0.00e+00 5.045 0.001 302.00 328.00 3 1.3535e+00 2.5222e-03 5.7988e-02 -6.0000e+00 3.6815e-01 -1.3568e-02 3.3077e-03 2.9691e-02 -6.0000e+00 3.9830e-01 -1.4995e-02 3.0654e-03 1.5334e-02 -6.0000e+00 2.3871e-01 -2.3936e-03 1.5261e-03 5.9548e-03 -6.0000e+00 1.0318e-01 4.9522e-04 -4.0153e-04 4.1163e-05 5.8149e-05 -6.0000e+00 7.0248e-03 -5.0284e-02 2.2908e-04 10 0 0 10 0 0 49.37 24.00 0.32 -0.05028 -0.05330 192 41 1 5 0 257.860 26.62 20.00 24.00 30.14 33.1 1094.63 -132664 -84190 -92428 -25350 -118216 -15862 -75014 -82940 -34008 -71461 -103083 -28740 -68560 -15544 -42557 -55376 -10942 4684 -12470 -8140 -8403 -16363 -1114 -21018 -11702 -11090 -8439 -23561 -7679 -12443 8551 -4277 -3757 -3173 -8978 4507 -4301 15611 -2491 -526 -3377 388 -2417 2985 2806 2462 -868 -714 5685 -1505 3910 -157 1652 1237 2469 248 2647 -682 943 -173 453 1020 65 2281 969 1587 487 76 276 1626 974 1024 711 134 1628 451 -1215 -1413 -268 -1269 -957 -1460 -1533 -1663 -945 -1014 -230 332 295 1088 1065 1282 297 413 -531 237 -28 334 164 -209 -142 -702 -524 -837 -420 -1279 -914 -961 -150 1416 159 155 570 403 273 102 -76 -153 -248 -29 -628 -150 -202 228 180 472 -119 800 360 339 439 113 99 -39 -173 -155 -135 52 136 -151 -21 -141 -209 -1381 -644 -841 -117 -1278 -67 -564 -776 -224 -754 -1576 -235 -1048 -180 -819 -1467 -212 86 -299 -200 -215 -457 -28 -709 -393 -396 -303 -883 -263 -477 313 -196 -200 -183 -535 231 -265 936 -221 -55 -386 46 -314 381 365 330 -123 -104 815 -247 674 -32 361 296 624 67 725 -194 259 -47 126 288 21 815 374 598 181 29 115 768 483 537 375 68 803 203 -512 -593 -122 -639 -564 -992 -1081 -1251 -754 -868 -207 307 275 979 899 1006 224 313 -445 227 -29 376 204 -266 -171 -822 -557 -881 -470 -1541 -1092 -1225 -206 2015 242 251 931 641 433 154 -114 -238 -389 -47 -1052 -244 -317 362 275 693 -169 1139 566 572 776 214 198 -79 -373 -339 -306 120 315 -343 -44 -300 -427 SS 20241003T131716.3Z 9042.553661 63 1 49.58 2 77.72 102.26 87.00 102.15 0.00 1 0.00 1 0 25 1.378e-01 5.105e-03 3.140e-02 1.043e-03 5.538268e-01 5.439497e-04 5.965386e-03 -6.000000e+00 7.920616e-02 227.53 -2.00 3.24 -2.00 320.16 0.00e+00 2.029791e-03 1.959064e-04 2.229125e-04 -6.000000e+00 3.624860e-03 292.15 -2.00 20.00 -2.00 319.38 0.00e+00 4.564 0.001 302.00 328.00 3 1.2421e+00 1.6515e-03 5.2588e-02 -6.0000e+00 1.9607e-01 -2.0336e-02 2.0721e-03 2.6993e-02 -6.0000e+00 2.1214e-01 -3.9926e-03 1.8082e-03 1.3546e-02 -6.0000e+00 1.2714e-01 -6.3119e-03 9.2606e-04 4.8946e-03 -6.0000e+00 5.4947e-02 9.1912e-04 -3.9341e-04 2.9119e-05 4.8337e-05 -6.0000e+00 3.7419e-03 -4.9988e-02 2.0462e-04 11 1 0 11 8 0 47.97 23.99 0.22 -0.04999 -0.05294 274 58 1 5 0 180.910 26.62 20.00 23.99 30.51 33.1 1097.00 -24193 -39887 -43679 -33226 -51724 -68486 -35343 -61417 6813 -45195 -45365 -25833 -39309 -14261 -22317 2197 -12429 1620 -5203 4500 -9875 -9364 -8530 -8637 -7498 -7174 -10085 -12998 -6267 -10651 530 -1096 1502 -1957 -4653 -3349 -3368 2942 -701 -1866 -882 -404 -631 668 2517 903 -445 51 426 470 924 1077 867 1815 1557 863 615 -445 91 256 143 526 1207 1663 1547 454 452 -396 422 698 744 824 568 286 596 257 -1294 -761 -789 -507 -978 -1172 -1530 -1410 -990 -655 -170 194 783 973 1026 1075 595 253 205 140 157 105 165 -199 -251 -676 -751 -493 -742 -995 -986 -777 -368 939 266 390 424 380 109 160 142 -120 -238 -222 -472 -286 -25 145 173 419 140 667 458 438 310 49 -147 96 -11 73 -187 75 -113 -151 -25 -87 -247 -166 -376 -464 -313 -540 -830 -333 -863 61 -677 -713 -370 -796 -285 -603 55 -375 47 -175 146 -384 -365 -345 -382 -357 -363 -539 -697 -306 -573 30 -73 113 -165 -392 -274 -279 271 -82 -268 -142 -70 -116 125 468 175 -89 10 89 96 208 270 239 538 492 286 212 -156 31 86 49 197 473 727 716 207 200 -179 205 388 433 506 351 170 326 136 -637 -367 -413 -290 -655 -844 -1219 -1192 -890 -595 -162 191 774 933 922 950 499 212 187 138 169 128 210 -259 -311 -807 -820 -531 -859 -1233 -1220 -1022 -519 1376 413 641 702 608 164 240 210 -186 -372 -367 -792 -468 -40 231 264 616 198 945 712 727 541 91 -275 189 -23 156 -398 162 -248 -322 -52 -174 -495 SS 20241003T132249.7Z 9042.557519 66 1 49.55 2 76.55 103.01 85.86 102.85 0.00 1 0.00 1 0 25 9.819e-02 5.243e-03 1.693e-02 8.008e-04 5.137388e-01 4.142372e-04 5.560092e-03 -6.000000e+00 5.644005e-02 227.53 -2.00 3.24 -2.00 319.83 0.00e+00 1.620829e-03 1.336869e-04 2.550255e-04 -6.000000e+00 2.582956e-03 292.15 -2.00 20.00 -2.00 319.02 0.00e+00 4.192 0.001 302.00 328.00 3 1.1701e+00 1.2149e-03 4.8447e-02 -6.0000e+00 1.3972e-01 -2.1213e-02 1.4823e-03 2.5062e-02 -6.0000e+00 1.5117e-01 -3.3760e-03 1.2266e-03 1.2359e-02 -6.0000e+00 9.0596e-02 -5.5519e-03 6.3858e-04 4.2424e-03 -6.0000e+00 3.9154e-02 1.4647e-03 -3.5079e-04 2.2593e-05 4.2996e-05 -6.0000e+00 2.6664e-03 -5.0127e-02 2.0157e-04 10 0 0 10 0 0 57.75 24.01 0.28 -0.05013 -0.05276 353 75 1 5 0 140.340 26.62 20.00 24.01 30.92 33.1 1099.43 -44181 -20684 -38742 -21870 -38656 -43914 -17035 -43223 11034 -35837 -9853 -24791 -11445 -20066 -6531 -5730 -3610 2735 -5492 2585 -5822 -398 -7085 -964 -8449 964 -6298 -3880 -8462 -3634 -1150 53 297 -1961 -2782 -4148 -1406 -1215 535 -2725 -80 -1624 -59 -892 798 309 -187 331 164 531 662 1535 191 2008 512 1295 628 474 266 272 390 598 934 1857 1879 335 694 -618 886 296 771 388 624 298 520 54 -1047 -1128 -886 -710 -1216 -953 -1727 -1209 -1159 -520 -255 202 491 1015 907 975 808 404 562 -44 217 302 289 -281 -238 -748 -769 -553 -703 -980 -868 -650 -398 695 130 472 236 356 -6 197 67 25 -187 -288 -553 -352 31 57 320 354 369 767 589 423 410 97 51 87 -53 42 -296 157 -38 -84 -196 -130 -364 -609 -263 -635 -297 -568 -664 -213 -804 136 -771 -170 -544 -267 -585 -205 -211 -145 113 -266 122 -310 -20 -400 -56 -572 63 -454 -265 -585 -249 -88 5 28 -201 -278 -412 -149 -152 81 -509 -16 -339 -13 -200 178 71 -43 78 40 134 183 467 64 718 184 480 242 184 101 102 150 250 436 957 953 178 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