File name: Pandora25s1_HoustonTX_20220912_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T155103.8Z 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_20220912_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: 20220912 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 20220912T130050.6Z 8290.542252 242 1 49.31 2 78.62 91.83 75.13 266.29 0.00 1 0.00 1 0 25 3.499e-01 8.442e-03 1.333e-01 1.996e-03 5.784540e-01 1.051348e-03 6.145669e-03 -6.000000e+00 2.027636e-01 228.61 -2.00 3.24 -2.00 320.61 0.00e+00 3.415891e-03 4.394217e-04 3.718631e-04 -6.000000e+00 9.410266e-03 293.67 -2.00 20.00 -2.00 319.83 0.00e+00 4.894 0.001 302.00 328.00 3 2.0788e+00 3.4068e-03 5.5984e-02 -6.0000e+00 5.0458e-01 -1.2115e-02 4.4310e-03 2.8197e-02 -6.0000e+00 5.4753e-01 -3.5809e-02 3.9670e-03 1.4665e-02 -6.0000e+00 3.2525e-01 8.1783e-03 1.9722e-03 6.1623e-03 -6.0000e+00 1.3848e-01 2.8870e-04 -4.4686e-04 5.6490e-05 6.0285e-05 -6.0000e+00 9.6932e-03 -3.3847e-03 1.0010e-04 11 8 0 10 0 0 34.73 24.66 0.33 -0.00338 -0.00674 111 24 1 5 0 444.140 27.15 20.00 24.66 31.08 27.4 984.54 -209896 225317 -95093 93568 -109342 -57329 900000 -75977 900000 -118257 -59928 -21113 -35093 -35705 -405 60839 18692 29975 3570 20872 -4643 15818 -27507 -3358 -18929 4718 -20509 2823 -20023 -19937 19540 23097 4501 -1910 -7685 5671 6783 23904 317 -5226 -2858 1751 4726 -78 3741 6143 173 867 3857 -557 3519 550 -44 3592 980 2234 906 -1534 678 -548 1547 -442 745 2498 619 969 1023 -87 2271 1316 763 1273 851 642 1437 278 -3027 -1708 -1980 -230 -701 -730 -2237 224 -1049 -933 -263 34 39 1300 1151 580 415 -404 -278 184 184 94 149 -285 -119 -1417 -815 -1002 32 -525 -947 -919 22 34 220 451 289 276 -109 268 79 -52 -318 -378 -307 67 389 183 580 587 368 673 685 293 327 -164 -231 314 -243 -7 -51 322 -177 -168 -1 -401 -313 -6150 438 -1132 182 -1327 -446 900000 -906 900000 -2437 -773 -216 -525 -646 -6 651 321 508 85 442 -130 364 -1039 -109 -771 160 -851 95 -853 -886 738 994 252 -119 -484 319 427 1530 30 -616 -366 229 631 -11 528 869 26 137 615 -100 676 115 -10 862 254 597 252 -433 183 -150 436 -141 254 930 241 364 379 -34 962 647 394 678 448 320 679 120 -1270 -723 -948 -122 -434 -489 -1654 172 -837 -794 -234 31 35 1117 962 456 314 -318 -235 178 197 110 188 -356 -138 -1571 -837 -1056 36 -605 -1157 -1202 30 50 351 724 462 438 -163 397 115 -79 -518 -619 -502 110 613 278 876 854 520 987 1082 500 588 -313 -449 641 -517 -16 -114 728 -402 -367 -3 -815 -639 SS 20220912T130651.6Z 8290.546431 245 1 49.43 2 77.31 92.59 76.39 267.05 0.00 1 0.00 1 0 25 1.510e-01 5.291e-03 4.650e-02 1.316e-03 5.310702e-01 6.843280e-04 5.672305e-03 -6.000000e+00 8.662674e-02 228.61 -2.00 3.24 -2.00 320.15 0.00e+00 1.102033e-03 2.454991e-04 2.449510e-04 -6.000000e+00 4.023657e-03 293.66 -2.00 20.00 -2.00 319.32 0.00e+00 4.427 0.001 302.00 328.00 3 1.8469e+00 2.0903e-03 5.0839e-02 -6.0000e+00 2.1481e-01 -3.6037e-02 2.6129e-03 2.5729e-02 -6.0000e+00 2.3279e-01 2.1094e-03 2.2313e-03 1.2690e-02 -6.0000e+00 1.3953e-01 -8.9534e-03 1.1414e-03 3.8891e-03 -6.0000e+00 6.0149e-02 5.9761e-04 -3.4346e-04 3.7424e-05 4.1922e-05 -6.0000e+00 4.1334e-03 -3.9041e-03 7.2040e-05 10 0 0 10 0 0 12.38 24.67 0.36 -0.00390 -0.00649 175 37 1 5 0 282.350 27.15 20.01 24.67 31.50 27.2 986.35 900000 -18552 -56339 1030 -62800 -48529 68218 -38578 68092 -52961 -34719 5574 -25956 -1764 -13736 65589 -5478 7791 -4017 2519 -171 -2154 -12237 -7243 -8439 -1724 -6905 -6181 -4303 -16595 5851 2022 3773 -2184 -5417 2003 -3173 7089 -405 -2542 -3055 447 56 26 340 1614 -1487 -1124 1722 -1101 1430 81 369 1096 1199 1130 1463 -1688 621 -562 366 1 1431 1561 611 520 16 60 872 1239 12 827 -49 332 710 397 -1854 -930 -770 -797 -807 -1217 -1379 -616 -482 -445 565 255 684 930 898 706 295 35 86 345 -68 438 115 -410 -298 -909 -657 -822 -692 -958 -957 -705 -215 1209 474 335 429 186 140 268 -19 -106 -300 -385 -615 -148 178 154 219 592 127 814 373 220 177 -82 -173 67 -64 -57 -82 172 -29 -210 58 -195 -129 900000 -169 -768 8 -809 -558 285 -518 372 -980 -567 71 -547 -37 -384 1004 -179 246 -151 94 -7 -87 -578 -357 -452 -91 -386 -331 -225 -1047 347 143 295 -186 -457 161 -301 730 -54 -402 -535 80 11 5 66 315 -303 -233 360 -250 349 22 108 340 389 380 502 -594 210 -192 129 0 606 716 288 236 7 28 438 696 7 517 -30 198 392 202 -910 -458 -416 -489 -557 -927 -1119 -520 -430 -417 545 252 673 885 811 605 245 29 79 351 -77 535 148 -524 -363 -1040 -716 -915 -813 -1174 -1219 -937 -301 1798 750 544 692 292 211 391 -28 -162 -476 -631 -1009 -238 279 236 327 859 180 1184 583 369 312 -150 -326 130 -131 -120 -176 371 -63 -445 120 -388 -252 SS 20220912T131229.6Z 8290.550342 248 1 49.57 2 76.09 93.30 77.56 267.76 0.00 1 0.00 1 0 25 8.369e-02 4.969e-03 2.079e-02 9.723e-04 4.897985e-01 4.980597e-04 5.261708e-03 -6.000000e+00 4.799502e-02 228.61 -2.00 3.24 -2.00 319.74 0.00e+00 7.821320e-04 1.557160e-04 1.838949e-04 -6.000000e+00 2.214234e-03 293.66 -2.00 20.00 -2.00 318.87 0.00e+00 4.064 0.001 302.00 328.00 3 1.6991e+00 1.4648e-03 4.6748e-02 -6.0000e+00 1.1902e-01 -3.9056e-02 1.7767e-03 2.3751e-02 -6.0000e+00 1.2896e-01 3.7616e-03 1.4187e-03 1.1550e-02 -6.0000e+00 7.7283e-02 -8.1926e-03 7.3901e-04 3.4370e-03 -6.0000e+00 3.3106e-02 1.0223e-03 -2.0990e-04 2.7650e-05 3.6528e-05 -6.0000e+00 2.2797e-03 -3.8642e-03 7.7770e-05 10 0 0 10 0 0 26.61 24.68 0.30 -0.00386 -0.00544 244 52 1 5 0 203.150 27.15 20.00 24.68 31.82 27.1 987.79 44281 -20975 -22581 -20820 -41631 -28629 5206 -23210 10617 -26784 -29751 2379 -24578 -3374 -13284 15192 -2617 1606 -884 1887 -1984 -3486 -4334 -2619 -3267 -2006 -2901 -6886 218 -8777 4492 2234 2211 -1562 -4696 -2057 -2064 3023 -1140 -1371 -1423 240 -600 -78 -299 826 -744 -860 377 -1110 890 -105 836 919 984 517 769 -422 330 68 1019 235 1212 1676 1016 581 35 -199 630 1060 382 869 88 478 452 279 -998 -963 -1054 -801 -965 -1142 -1717 -925 -668 -621 113 330 820 803 802 727 508 384 180 206 293 529 87 -236 -348 -862 -633 -563 -810 -973 -833 -617 -84 779 264 235 339 14 -31 237 144 -26 -219 -297 -421 -199 23 196 342 473 268 879 416 393 310 -96 -80 159 -59 -70 -153 123 -3 -148 -97 -290 -143 344 -320 -364 -310 -707 -434 63 -430 158 -619 -736 48 -803 -110 -529 570 -118 75 -45 99 -111 -200 -267 -174 -235 -150 -219 -517 15 -706 365 214 238 -180 -531 -231 -263 407 -196 -279 -320 56 -148 -20 -76 210 -194 -228 101 -299 259 -34 291 344 386 212 322 -178 135 28 433 103 592 890 550 301 18 -104 362 650 258 605 61 312 271 161 -544 -528 -641 -531 -737 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