File name: Pandora25s1_HoustonTX_20220618_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T150345.1Z 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 v1.8.75 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20220618_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: 20220618 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 20220618T132103.3Z 8204.556289 246 1 48.69 2 66.54 75.47 64.57 226.64 0.00 1 0.00 1 0 17 1.001e-01 1.687e-02 1.086e-02 2.179e-03 3.379549e-01 1.108357e-03 3.668700e-03 -6.000000e+00 5.781214e-02 230.84 -2.00 3.24 -2.00 318.05 0.00e+00 2.173922e-03 2.015119e-04 1.121004e-04 -6.000000e+00 2.637774e-03 292.80 -2.00 20.00 -2.00 317.13 0.00e+00 2.492 0.000 302.00 328.00 3 4.8591e+00 3.0030e-03 2.9777e-02 -6.0000e+00 1.4419e-01 4.9936e-02 3.4182e-03 1.6431e-02 -6.0000e+00 1.5602e-01 -2.8478e-02 2.1262e-03 7.9569e-03 -6.0000e+00 9.3276e-02 1.4837e-02 1.0799e-03 2.7994e-03 -6.0000e+00 3.9696e-02 2.1951e-04 6.9402e-05 6.2696e-05 2.7596e-05 -6.0000e+00 2.7277e-03 1.1296e-03 5.7978e-05 12 9 8 11 32 0 98.91 23.95 0.39 0.00113 0.00165 22 5 1 5 0 2212.910 26.51 19.99 23.95 35.74 25.5 1015.28 -98321 19343 550 21325 -2149 4653 27468 10539 21883 4756 -12060 16138 -5676 9255 4934 17676 8707 11632 8180 10966 8712 4320 2264 5734 -468 787 -1427 929 -817 987 10480 4991 6226 2992 -3607 2779 3167 4181 910 -623 -2341 369 1640 1439 2752 2162 -999 -305 1438 588 3067 395 1590 1064 528 141 1595 -2626 137 -534 1312 -333 988 1472 -102 75 -801 -1137 -134 357 430 -155 238 60 344 64 -1800 -2268 278 -1056 -1086 -1374 -2400 -1649 -1375 -947 -527 -53 -347 85 296 464 -576 -210 -1198 303 318 768 487 -353 -138 -1197 -149 -503 344 -228 -884 -674 818 500 470 666 590 48 -323 247 -307 62 230 386 -1 265 746 763 382 892 170 1095 533 680 91 74 -251 177 -192 -41 -63 201 -253 -434 -97 -1000 -771 -16563 1189 41 1196 -137 276 1428 717 1458 383 -1134 1265 -632 1048 667 2319 1308 1790 1353 1833 1496 770 426 1102 -99 170 -310 187 -161 198 2110 1156 1542 764 -923 681 856 1301 341 -265 -1080 173 780 690 1313 1039 -488 -147 683 289 1565 219 918 643 328 90 1012 -1711 86 -338 849 -233 735 1143 -79 55 -569 -813 -102 297 378 -140 213 52 279 48 -1287 -1608 206 -871 -979 -1333 -2451 -1737 -1518 -1092 -626 -64 -418 98 326 481 -572 -208 -1262 341 387 998 655 -470 -176 -1446 -173 -604 431 -298 -1197 -942 1178 756 737 1052 912 72 -458 338 -422 88 341 590 -1 405 1115 1111 541 1218 227 1472 755 1013 141 118 -404 291 -329 -73 -114 364 -461 -777 -169 -1708 -1297 SS 20220618T133427.7Z 8204.565598 251 1 18.73 2 63.71 76.81 66.63 229.16 0.00 1 0.00 1 0 25 8.907e-03 4.984e-03 1.282e-03 4.435e-04 3.073865e-01 2.274706e-04 3.373208e-03 -6.000000e+00 5.144856e-03 230.84 -2.00 3.24 -2.00 317.08 0.00e+00 2.815729e-04 3.177661e-05 8.564908e-05 -6.000000e+00 2.348281e-04 292.80 -2.00 20.00 -2.00 316.17 0.00e+00 2.244 0.000 302.00 328.00 3 1.2723e+00 6.0220e-04 2.6880e-02 -6.0000e+00 1.2831e-02 8.3795e-03 6.7665e-04 1.4775e-02 -6.0000e+00 1.3887e-02 -4.4951e-03 3.9912e-04 7.1341e-03 -6.0000e+00 8.3017e-03 -2.1799e-04 1.9444e-04 1.9435e-03 -6.0000e+00 3.5318e-03 1.0813e-02 -1.4977e-04 1.2649e-05 2.2349e-05 -6.0000e+00 2.4286e-04 2.1166e-03 -3.6451e-06 12 1 1 12 1 1 99.78 23.92 0.29 0.00212 0.00099 283 160 1 5 0 65.350 26.51 20.01 23.92 36.06 25.8 1018.19 -1790 -1630 -1361 -2545 -3200 -3559 -1144 -1040 -80 -1768 -2253 -1927 -1543 -1170 -93 422 26 631 337 1304 757 521 211 569 338 432 97 -268 -397 167 952 732 1023 -875 -2038 -2147 -1928 -969 -238 -611 -663 -574 -340 -316 -10 5 -402 -221 -476 33 674 809 808 991 784 1016 729 737 502 574 861 1168 1418 1376 447 -239 -534 -652 461 423 218 302 138 260 188 -112 -754 -964 -753 -777 -957 -967 -1651 -1284 -844 -521 -227 68 345 300 289 104 -182 140 220 232 499 644 205 -237 -481 -796 -461 -85 -542 -741 -459 -475 11 423 380 319 274 42 -59 62 160 90 158 -27 -201 -23 228 294 534 371 285 726 505 412 214 -48 -150 -7 98 -15 -82 137 -108 -190 -225 -403 -503 -220 -199 -166 -310 -356 -398 -137 -141 -11 -253 -323 -296 -273 -240 -20 99 6 162 91 360 212 146 62 166 104 137 30 -84 -118 51 291 246 372 -324 -714 -765 -770 -428 -118 -331 -387 -349 -201 -187 -6 3 -248 -133 -286 20 419 540 543 701 573 758 528 555 371 425 632 928 1170 1201 385 -192 -425 -520 380 378 202 289 130 245 171 -91 -594 -743 -625 -700 -930 -992 -1741 -1366 -960 -608 -268 82 412 355 328 113 -191 145 235 266 612 814 272 -308 -607 -958 -549 -102 -679 -947 -612 -643 15 623 573 486 401 59 -80 81 212 125 228 -41 -303 -34 326 415 741 491 374 964 698 593 315 -74 -227 -11 159 -25 -139 230 -182 -321 -365 -649 -796 SS 20220618T133932.6Z 8204.569127 254 1 49.80 2 62.64 77.31 67.43 230.09 0.00 1 0.00 1 0 17 2.412e-02 6.100e-03 3.821e-03 1.225e-03 2.983720e-01 6.255107e-04 3.265947e-03 -6.000000e+00 1.393481e-02 230.84 -2.00 3.24 -2.00 317.22 0.00e+00 1.890142e-05 9.094191e-05 6.167546e-05 -6.000000e+00 6.358748e-04 292.80 -2.00 20.00 -2.00 316.31 0.00e+00 2.164 0.000 302.00 328.00 3 4.2549e+00 1.6602e-03 2.5974e-02 -6.0000e+00 3.4754e-02 3.1171e-02 1.8702e-03 1.4348e-02 -6.0000e+00 3.7608e-02 1.6443e-03 1.1123e-03 6.9290e-03 -6.0000e+00 2.2483e-02 -4.0800e-03 5.4604e-04 1.8825e-03 -6.0000e+00 9.5676e-03 5.9244e-04 7.1195e-06 3.5053e-05 2.1344e-05 -6.0000e+00 6.5757e-04 1.1272e-03 3.0372e-05 10 0 0 10 0 0 99.80 23.92 0.22 0.00113 0.00118 47 10 1 5 0 1059.390 26.51 20.00 23.92 36.41 25.6 1019.91 -14938 2344 -5526 1480 -5844 -4117 5765 -1575 3396 -1229 -6444 643 -3305 -862 -398 17474 774 169 -704 1694 846 -535 -1511 323 -683 933 -1577 262 -1421 -313 2829 798 1165 -938 -3247 -1541 -925 -210 380 -993 -1124 -305 28 -122 215 -123 -1051 -888 -359 -522 1066 321 785 888 248 696 1159 81 410 582 871 578 1266 1192 187 -367 -740 -1092 691 564 415 344 399 242 397 316 -902 -746 -175 -413 -920 -1016 -1814 -803 -718 -599 -219 126 322 345 418 666 -112 248 -45 103 399 611 405 -273 -336 -769 -360 -504 -77 -784 -583 -455 -28 310 208 302 298 -62 -112 -135 73 -79 162 -2 -213 -66 204 333 375 488 289 813 462 313 185 -158 -217 238 50 -3 27 298 -138 -124 -85 -548 -545 -1834 263 -668 155 -598 -414 578 -190 427 -166 -909 91 -547 -159 -82 3326 177 41 -177 430 218 -139 -412 92 -205 283 -481 74 -392 -87 818 253 393 -322 -1078 -511 -335 -87 181 -530 -636 -177 16 -72 127 -73 -619 -515 -206 -306 650 207 527 618 177 505 846 60 295 419 645 454 1048 1025 160 -298 -578 -856 570 505 392 332 382 225 350 259 -702 -570 -140 -361 -871 -1025 -1912 -869 -813 -707 -266 155 395 411 473 712 -114 252 -48 118 485 788 539 -359 -425 -925 -420 -606 -96 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