File name: Pandora25s1_HoustonTX_20241117_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20241119T084408.5Z 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 v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20241117_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: 20241117 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 20241117T145221.9Z 9087.619698 313 1 10.43 2 67.66 130.09 90.51 302.28 0.00 1 0.00 1 0 17 1.822e-02 6.014e-03 7.248e-03 2.517e-03 2.721910e-01 1.267707e-03 3.063093e-03 -6.000000e+00 1.037052e-02 224.98 -2.00 3.24 -2.00 317.05 0.00e+00 -4.565541e-04 1.760979e-04 8.480338e-05 -6.000000e+00 4.717398e-04 288.36 -2.00 20.00 -2.00 316.23 0.00e+00 2.608 0.000 302.00 328.00 3 3.7496e+00 3.3144e-03 2.8897e-02 -6.0000e+00 2.5555e-02 1.7337e-02 3.7317e-03 1.2975e-02 -6.0000e+00 2.7721e-02 8.1116e-03 2.2253e-03 6.3485e-03 -6.0000e+00 1.6608e-02 -5.9847e-03 1.1006e-03 1.8456e-03 -6.0000e+00 7.1863e-03 6.8283e-04 -4.5730e-04 7.2275e-05 2.1515e-05 -6.0000e+00 4.9459e-04 -5.0714e-02 9.0362e-05 12 1 1 12 1 1 99.83 24.00 0.27 -0.05071 -0.05415 11 12 1 5 0 868.780 26.62 19.99 24.00 29.54 32.9 1081.84 -3724 -1840 -2103 -1437 1387 -11030 6368 -4171 5095 -2628 -122 -138 -3104 -1335 -2099 11253 -1012 858 -165 1230 341 18 514 1166 -682 657 -404 -840 -347 -1910 1839 2459 1156 -749 -1717 -2643 -724 718 -723 -1324 -1142 -877 -680 93 -541 408 -1211 -861 15 -40 110 164 -59 1216 512 1113 1281 355 1032 281 1219 -34 1538 1274 645 -101 -594 -385 35 15 384 929 -328 456 503 536 -650 -552 -788 116 -881 -1005 -942 -1310 -1016 -782 -310 -60 496 363 358 298 216 -182 503 -47 336 330 501 -339 -202 -618 -980 -165 -198 -269 -722 -1033 -159 144 365 721 83 100 -12 -199 101 -34 245 -70 -301 79 -13 424 225 876 -89 560 694 413 283 165 -471 237 -36 198 -53 494 6 -522 -216 -523 -411 -450 -239 -282 -182 154 -1317 687 -554 692 -404 -18 -21 -541 -259 -462 2406 -252 217 -44 333 95 5 145 344 -215 213 -133 -265 -103 -563 550 784 399 -271 -599 -907 -261 289 -340 -707 -657 -522 -414 57 -332 248 -739 -516 9 -24 67 106 -40 847 368 810 946 264 755 205 901 -27 1260 1096 562 -84 -474 -300 28 13 358 893 -319 433 458 456 -521 -426 -620 98 -812 -992 -974 -1402 -1131 -909 -373 -74 611 439 416 328 225 -185 523 -52 397 415 659 -449 -259 -756 -1155 -194 -245 -347 -960 -1415 -224 209 550 1101 126 146 -17 -267 134 -46 343 -102 -449 118 -19 609 314 1187 -117 732 935 582 414 246 -715 366 -58 325 -89 838 10 -891 -361 -859 -663 SS 20241117T145651.4Z 9087.622817 316 1 46.11 2 66.92 130.91 91.29 302.81 0.00 1 0.00 1 0 17 6.470e-02 6.772e-03 6.469e-03 1.875e-03 2.657139e-01 9.427816e-04 2.979989e-03 -6.000000e+00 3.683708e-02 224.98 -2.00 3.24 -2.00 317.31 0.00e+00 -3.055755e-04 1.397105e-04 5.347194e-05 -6.000000e+00 1.674324e-03 288.36 -2.00 20.00 -2.00 316.48 0.00e+00 2.530 0.000 302.00 328.00 3 4.5886e+00 2.4770e-03 2.8070e-02 -6.0000e+00 9.0778e-02 3.6258e-02 2.7954e-03 1.2647e-02 -6.0000e+00 9.8451e-02 1.0803e-02 1.6884e-03 6.2004e-03 -6.0000e+00 5.8983e-02 -8.3044e-03 8.4587e-04 1.7680e-03 -6.0000e+00 2.5540e-02 3.1768e-04 2.1849e-04 5.4303e-05 2.0486e-05 -6.0000e+00 1.7554e-03 -5.1791e-02 2.3926e-04 12 9 1 12 9 1 100.00 23.99 0.12 -0.05179 -0.05015 48 11 1 5 0 940.800 26.51 20.00 23.99 29.94 33.1 1085.52 72093 -534 -3247 -1074 -3313 -5418 12077 -6963 8911 -4159 -3698 1460 -4881 -339 -2828 3101 -2421 1172 -1090 1473 -474 645 -767 670 -1291 1187 -537 -744 -70 -420 3847 1529 1843 -841 -2348 -1508 -1129 2204 -1036 -1236 -1347 -262 -758 -427 -172 328 -2031 -1244 -209 -501 530 167 182 1099 819 1003 1062 11 1157 -8 1276 359 1138 1170 627 -307 -262 -737 184 405 771 918 138 -3 714 1062 -1274 -308 -394 117 -1030 -1087 -1490 -936 -993 -1100 -1 -308 305 485 482 202 270 -14 295 283 533 556 438 -53 -231 -889 -457 -128 -237 -578 -630 -602 -338 256 282 254 527 -101 -33 68 -187 -331 -146 -304 -318 -130 114 385 560 582 -110 816 432 535 342 115 -268 428 -153 42 128 454 -41 -286 -246 -722 -264 3926 -62 -396 -122 -346 -552 1105 -848 1046 -582 -514 197 -773 -58 -565 642 -552 268 -264 361 -121 162 -199 181 -374 350 -161 -214 -19 -111 1022 446 576 -279 -751 -466 -372 805 -454 -621 -735 -148 -440 -250 -100 190 -1188 -710 -117 -281 306 103 117 734 565 704 756 8 814 -5 907 270 910 985 535 -251 -201 -556 143 344 703 869 132 -3 635 875 -989 -227 -296 95 -926 -1055 -1529 -990 -1100 -1283 -1 -382 378 590 560 221 278 -13 301 310 626 701 581 -70 -298 -1090 -534 -150 -293 -750 -843 -831 -481 379 434 396 811 -150 -47 92 -248 -450 -206 -450 -483 -196 169 559 787 793 -145 1061 584 758 505 173 -411 667 -248 71 219 787 -73 -498 -420 -1208 -432 SS 20241117T152023.0Z 9087.639155 330 1 4.55 2 63.19 135.46 95.32 305.74 0.00 1 0.00 1 0 17 7.339e-02 8.689e-03 8.647e-03 3.871e-03 2.357369e-01 1.959685e-03 2.701318e-03 -6.000000e+00 4.169858e-02 224.98 -2.00 3.24 -2.00 316.25 0.00e+00 -2.839976e-04 2.236360e-04 5.365151e-05 -6.000000e+00 1.899431e-03 288.36 -2.00 20.00 -2.00 315.47 0.00e+00 2.205 0.000 302.00 328.00 3 4.0665e+00 5.0575e-03 2.4575e-02 -6.0000e+00 1.0275e-01 3.1891e-02 5.6607e-03 1.1273e-02 -6.0000e+00 1.1152e-01 3.1913e-03 3.2908e-03 5.5311e-03 -6.0000e+00 6.6810e-02 -4.9708e-03 1.5660e-03 1.6088e-03 -6.0000e+00 2.8866e-02 7.7447e-04 -2.1865e-03 1.1042e-04 2.0017e-05 -6.0000e+00 1.9934e-03 -4.7270e-02 -2.2333e-04 12 9 1 12 1 1 98.34 23.99 0.46 -0.04727 -0.06370 3 9 1 5 0 1136.320 26.51 19.99 23.99 31.32 32.9 1091.29 84408 -123 -5795 456 -5734 -2034 467 412 2136 -712 -4983 -1074 -434 -1229 -845 5428 713 704 203 -1020 441 -1462 1229 -1399 -772 73 -174 872 -573 612 -64 1839 -381 66 -2666 -1861 -2379 1278 -423 -563 -233 -762 -268 -885 -115 -456 -422 -939 -267 -1067 1031 627 17 859 1321 761 814 565 348 272 714 1033 273 542 657 -66 -4 -990 -25 657 836 447 519 -185 1139 210 -775 -1135 -173 163 -1071 -1041 -1540 -771 -1002 -400 -264 -297 480 506 25 519 -282 417 619 163 377 778 314 61 -128 -816 -51 -278 147 -953 -899 -907 228 287 104 226 251 230 -361 97 -12 120 -126 -62 -665 92 136 240 393 528 319 1139 355 129 5 -163 -647 142 147 127 6 245 -96 64 -452 101 -511 7376 -24 -1234 87 -1044 -344 81 79 446 -160 -1147 -243 -106 -337 -256 1682 238 241 72 -374 162 -543 455 -551 -316 30 -73 347 -218 226 -25 737 -164 29 -1145 -776 -1057 619 -236 -351 -155 -524 -187 -625 -81 -320 -293 -642 -179 -717 704 450 13 661 1036 607 657 458 279 217 577 869 243 502 610 -59 -3 -823 -21 601 812 449 524 -184 1081 188 -654 -922 -142 143 -1018 -1053 -1630 -837 -1131 -470 -321 -368 596 618 30 577 -299 427 647 180 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