File name: Pandora25s1_HoustonTX_20220828_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T154845.5Z 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_20220828_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: 20220828 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 20220828T125314.5Z 8275.536974 62 1 49.44 2 78.66 85.34 92.71 79.46 0.00 1 0.00 1 0 25 2.564e-01 1.481e-02 3.022e-02 8.686e-04 6.015038e-01 4.547799e-04 6.551434e-03 -6.000000e+00 1.473149e-01 229.08 -2.00 3.24 -2.00 320.42 0.00e+00 5.184825e-03 1.805504e-04 1.668865e-03 -6.000000e+00 6.800309e-03 294.19 -2.00 20.00 -2.00 319.64 0.00e+00 4.908 0.001 302.00 328.00 3 4.5174e-01 1.4350e-03 5.6875e-02 -6.0000e+00 3.6566e-01 7.7518e-02 1.8167e-03 2.9506e-02 -6.0000e+00 3.9602e-01 -1.2020e-01 1.5694e-03 1.6000e-02 -6.0000e+00 2.3732e-01 4.8959e-02 7.9476e-04 6.1931e-03 -6.0000e+00 1.0161e-01 1.3498e-03 -4.2015e-04 2.3794e-05 7.7206e-05 -6.0000e+00 6.9866e-03 -3.5637e-03 7.4366e-05 12 8 8 10 0 0 9.88 24.67 0.27 -0.00356 -0.00672 433 92 1 5 0 114.150 27.15 19.99 24.67 34.62 27.2 1004.46 -253908 -13760 -38996 -18863 -54387 -52273 -16699 -37063 8113 -56596 -34711 -20688 -6742 4821 -1476 90067 15610 20400 11434 13451 10688 10988 4166 6015 738 6736 -1403 2904 2840 1862 10231 13769 9582 8454 1951 5333 5177 9903 5173 3787 3522 4379 6041 4739 6427 6121 5436 4521 6161 4969 5570 4144 4085 5149 3251 3095 1946 849 1113 1187 1959 2778 3365 3700 2845 1905 1421 368 1480 1046 694 171 59 -301 152 -804 -1782 -1893 -1181 -702 -1002 -1271 -2123 -1650 -1641 -1426 -721 -403 79 409 211 82 -484 -563 -740 -391 1 140 -53 -164 -293 -881 -861 -771 -952 -1101 -915 -784 -145 639 345 297 243 297 -20 198 243 108 138 127 -32 332 638 664 829 749 626 947 612 593 345 90 -13 -20 -76 -205 -256 -19 -97 -229 -185 -384 -650 -15236 -103 -357 -147 -507 -479 -129 -360 61 -785 -406 -247 -90 74 -30 946 351 482 318 385 319 328 141 215 27 266 -55 116 115 78 471 724 601 555 130 350 383 840 562 453 467 616 878 716 974 956 875 760 1065 936 1163 975 1050 1313 887 877 570 249 317 338 583 915 1252 1524 1217 796 590 160 664 541 393 101 34 -164 75 -362 -819 -895 -586 -410 -640 -922 -1687 -1302 -1388 -1283 -677 -386 75 371 179 69 -395 -477 -663 -381 1 168 -68 -210 -351 -1012 -918 -840 -1119 -1299 -1140 -1045 -200 926 551 474 403 471 -29 299 372 165 224 206 -55 538 997 1001 1256 1093 886 1395 965 998 635 169 -26 -41 -162 -440 -563 -43 -216 -493 -392 -769 -1269 SS 20220828T125926.9Z 8275.541284 65 1 49.48 2 77.31 86.09 91.44 80.23 0.00 1 0.00 1 0 25 1.134e-01 4.529e-03 1.582e-02 6.285e-04 5.527812e-01 3.247010e-04 5.887589e-03 -6.000000e+00 6.513527e-02 229.08 -2.00 3.24 -2.00 319.99 0.00e+00 1.261743e-03 1.115239e-04 2.195983e-04 -6.000000e+00 3.006921e-03 294.19 -2.00 20.00 -2.00 319.14 0.00e+00 4.426 0.001 302.00 328.00 3 3.9152e-01 9.7724e-04 5.1430e-02 -6.0000e+00 1.6168e-01 1.1908e-02 1.2073e-03 2.6832e-02 -6.0000e+00 1.7510e-01 -8.9318e-03 1.0113e-03 1.3130e-02 -6.0000e+00 1.0493e-01 -4.4778e-03 5.2276e-04 4.2185e-03 -6.0000e+00 4.4926e-02 2.4120e-03 -2.4075e-04 1.7390e-05 4.2173e-05 -6.0000e+00 3.0893e-03 -3.5890e-03 6.3421e-05 10 0 0 10 0 0 12.94 24.66 0.27 -0.00359 -0.00540 589 125 1 5 0 83.990 27.15 20.00 24.66 35.23 27.0 1007.35 -55438 -46013 -28528 -40609 -34170 -48054 -17753 -43235 -12081 -40359 -33591 -11801 -22295 -7777 -11120 1566 -7670 2712 -4835 -702 -4710 -3816 -5865 -4228 -4270 -4184 -4976 -6169 -3006 -6986 -526 -887 1289 -3332 -4789 -4733 -2696 -633 -1588 -1304 -1683 -15 145 87 109 851 -590 -181 -443 278 820 668 732 1144 807 924 864 46 384 67 765 1011 1508 1772 1197 452 271 -279 661 733 388 504 256 578 227 196 -931 -1028 -732 -707 -872 -856 -1510 -1264 -860 -558 109 189 711 803 896 600 256 232 265 165 191 499 127 -105 -312 -726 -577 -425 -772 -1009 -593 -652 -99 428 227 254 251 147 19 238 258 -60 -183 -247 -481 -219 66 168 321 438 235 813 428 432 257 -3 -53 28 -61 -134 -194 114 -38 -63 -68 -193 -188 -646 -554 -332 -459 -371 -557 -187 -619 -158 -681 -558 -182 -478 -181 -328 47 -282 99 -204 -30 -214 -174 -268 -209 -229 -236 -284 -343 -161 -424 -35 -70 112 -315 -438 -443 -281 -78 -225 -217 -313 -3 29 18 23 181 -129 -41 -103 69 209 189 226 380 283 337 324 17 140 24 290 424 663 855 593 217 128 -137 359 427 248 333 167 354 136 106 -477 -536 -427 -453 -648 -675 -1298 -1084 -788 -545 111 187 734 792 821 544 223 208 250 170 224 628 163 -134 -388 -865 -641 -484 -904 -1251 -772 -864 -142 644 357 414 406 226 29 344 377 -91 -287 -403 -786 -345 105 257 470 645 335 1199 672 722 446 -5 -97 54 -122 -281 -402 240 -80 -133 -136 -382 -363 SS 20220828T130459.7Z 8275.545135 68 1 49.52 2 76.11 86.76 90.30 80.92 0.00 1 0.00 1 0 25 6.479e-02 4.414e-03 9.258e-03 4.949e-04 5.111474e-01 2.540503e-04 5.470193e-03 -6.000000e+00 3.721567e-02 229.08 -2.00 3.24 -2.00 319.66 0.00e+00 8.849374e-04 7.758307e-05 1.838997e-04 -6.000000e+00 1.718012e-03 294.19 -2.00 20.00 -2.00 318.78 0.00e+00 4.069 0.001 302.00 328.00 3 3.4690e-01 7.4118e-04 4.7346e-02 -6.0000e+00 9.2375e-02 6.5985e-03 8.9439e-04 2.4723e-02 -6.0000e+00 1.0005e-01 -6.0965e-03 7.0680e-04 1.2007e-02 -6.0000e+00 5.9953e-02 -4.5342e-03 3.6980e-04 3.6020e-03 -6.0000e+00 2.5669e-02 3.7090e-03 -1.6157e-04 1.3843e-05 3.8076e-05 -6.0000e+00 1.7651e-03 -3.6461e-03 6.4044e-05 10 0 0 10 0 0 2.75 24.66 0.25 -0.00365 -0.00486 742 157 1 5 0 66.630 27.15 20.00 24.66 35.69 26.9 1009.69 -22725 -19333 -20457 -23956 -25249 -28651 -15022 -25594 -11217 -24448 -16534 -11793 -9797 -5751 -5401 1714 -2303 4 -3101 257 -1683 -2102 -3587 -1959 -3677 -1404 -3840 -3310 -3484 -3062 -806 -843 441 -2388 -3591 -4534 -2801 -1630 -848 -1201 -923 -536 33 -422 138 154 -531 -107 -319 -69 479 832 585 1079 729 926 805 486 398 494 700 1080 1665 1669 1019 267 150 -231 636 687 428 543 353 539 384 25 -725 -877 -530 -597 -836 -975 -1633 -1319 -1014 -612 -133 159 524 651 733 692 493 372 210 138 412 467 211 -154 -336 -726 -575 -373 -665 -888 -566 -595 -180 354 234 239 195 122 -27 154 154 -2 -67 -203 -309 -181 115 172 360 331 246 715 544 398 287 -10 -27 22 26 -80 -195 89 -58 -135 -116 -164 -243 -316 -293 -326 -372 -368 -440 -225 -492 -211 -559 -364 -283 -284 -198 -225 70 -108 0 -170 14 -98 -124 -229 -135 -278 -109 -306 -251 -260 -245 -73 -89 52 -296 -429 -558 -354 -246 -156 -261 -221 -126 8 -105 35 39 -137 -28 -87 -20 151 289 221 408 290 382 341 205 164 203 300 509 875 900 561 142 78 -123 374 435 297 389 249 360 250 15 -401 -490 -329 -407 -658 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