File name: Pandora25s1_HoustonTX_20220830_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T154635.9Z 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_20220830_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: 20220830 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 20220830T140212.7Z 8277.584869 95 1 23.51 2 63.91 94.70 102.28 87.69 0.00 1 0.00 1 0 17 2.250e-02 6.545e-03 5.627e-03 2.011e-03 2.798137e-01 1.021445e-03 3.097290e-03 -6.000000e+00 1.292271e-02 229.01 -2.00 3.24 -2.00 316.99 0.00e+00 -1.996622e-04 1.413674e-04 5.271378e-05 -6.000000e+00 5.965647e-04 294.12 -2.00 20.00 -2.00 316.06 0.00e+00 2.260 0.000 302.00 328.00 3 4.3970e+00 2.6903e-03 2.6177e-02 -6.0000e+00 3.2072e-02 2.3772e-02 3.0310e-03 1.3417e-02 -6.0000e+00 3.4738e-02 3.4672e-03 1.7849e-03 6.5045e-03 -6.0000e+00 2.0817e-02 -4.7734e-03 8.6961e-04 1.7862e-03 -6.0000e+00 8.9128e-03 4.8989e-04 -8.5922e-05 5.7530e-05 2.0830e-05 -6.0000e+00 6.1310e-04 -3.2608e-03 6.0712e-05 12 9 1 12 1 1 92.27 24.67 0.35 -0.00326 -0.00391 12 6 1 5 0 1795.240 27.15 20.00 24.67 36.80 27.2 1015.04 11601 224 -1602 -416 -6461 -7700 4992 -5522 8205 -8466 -2435 -1239 -4074 -1669 -1870 12348 -1075 1714 -1075 1099 650 405 -660 1295 -1126 955 -1162 -65 -658 217 562 1511 1048 -2422 -2553 -1538 -1157 1158 325 -532 -1076 -240 228 -823 480 158 -1422 -1070 429 -823 287 198 -209 955 745 615 1091 -130 937 267 836 671 950 1151 505 -598 -237 -706 945 100 395 461 373 376 779 307 -966 -669 -1098 -384 -1125 -1321 -1815 -634 -708 -776 -129 501 293 866 476 -34 95 -428 135 347 560 858 712 -109 -406 -1292 -563 -266 -31 -674 -565 -653 195 383 292 389 382 -227 74 -15 -174 -300 -33 -414 -340 -67 224 92 657 366 -12 962 364 346 453 -195 -120 442 159 -210 40 282 -271 -67 -111 -347 -550 1301 30 -217 -51 -770 -922 579 -790 1136 -1402 -380 -202 -765 -347 -436 2735 -277 448 -298 308 185 115 -196 399 -370 317 -387 -20 -197 65 178 510 378 -900 -902 -543 -445 500 163 -297 -638 -146 141 -513 297 97 -877 -649 255 -502 182 132 -145 683 545 458 818 -98 691 198 635 538 804 1009 439 -497 -188 -561 786 91 376 449 362 355 697 257 -767 -519 -894 -338 -1072 -1340 -1918 -687 -801 -916 -157 616 360 1032 542 -36 98 -437 143 393 677 1098 939 -143 -512 -1557 -658 -319 -39 -876 -755 -897 275 561 441 590 567 -325 100 -19 -231 -409 -47 -609 -505 -98 324 130 899 488 -15 1252 495 491 661 -291 -182 681 253 -346 67 475 -460 -112 -182 -557 -873 SS 20220830T140758.8Z 8277.588875 98 1 49.98 2 62.66 95.47 101.08 88.41 0.00 1 0.00 1 0 17 7.931e-02 2.147e-02 4.647e-03 1.674e-03 2.654270e-01 8.470180e-04 2.941281e-03 -6.000000e+00 4.554963e-02 229.01 -2.00 3.24 -2.00 317.02 0.00e+00 2.634518e-03 1.180875e-04 1.125323e-04 -6.000000e+00 2.102514e-03 294.12 -2.00 20.00 -2.00 316.10 0.00e+00 2.166 0.000 302.00 328.00 3 4.8563e+00 2.2358e-03 2.5067e-02 -6.0000e+00 1.1305e-01 5.1409e-02 2.5206e-03 1.3202e-02 -6.0000e+00 1.2244e-01 -3.8366e-02 1.4686e-03 6.2599e-03 -6.0000e+00 7.3374e-02 2.2873e-02 7.0769e-04 2.6915e-03 -6.0000e+00 3.1418e-02 3.4187e-04 -3.1389e-05 4.7948e-05 2.5619e-05 -6.0000e+00 2.1607e-03 -3.7569e-03 6.7266e-05 12 8 8 10 0 0 99.86 24.67 0.36 -0.00376 -0.00399 33 7 1 5 0 1514.240 27.15 20.00 24.67 36.84 27.1 1014.98 -77332 18727 12626 17157 6534 6415 21137 5134 17214 -3853 1706 4764 3472 5055 5786 12565 7548 10069 7088 10219 7798 6219 3542 4414 1616 3161 -1866 2332 1569 1761 6493 5435 4479 1564 -308 1258 649 3296 1021 -1253 -866 96 483 -195 954 803 -386 387 1581 84 1232 653 139 1520 271 272 -341 -2070 -560 -757 269 546 1426 1510 519 -670 -712 -1319 217 -499 -267 -28 -254 -759 -47 -675 -2436 -1729 -1252 -904 -1741 -1269 -2466 -820 -1140 -1404 -400 -142 234 75 112 -155 -257 -643 -462 249 411 710 829 -58 116 -1060 -355 -536 46 -173 3 -476 564 867 711 801 480 -79 -334 -208 -163 162 215 221 257 583 930 473 955 688 209 1032 786 1077 227 -84 -311 627 -274 -67 -231 34 -508 -547 -533 -796 -1000 -21760 2396 1708 2047 776 747 2292 712 2307 -637 264 757 633 1036 1325 2910 1896 2567 1914 2766 2163 1732 1033 1329 515 1017 -617 704 456 517 1955 1774 1571 561 -106 429 242 1379 501 -695 -507 58 295 -120 585 493 -236 231 926 50 767 430 96 1073 196 200 -253 -1550 -409 -556 203 435 1199 1319 451 -552 -559 -1034 178 -450 -254 -27 -246 -715 -41 -558 -1910 -1318 -999 -784 -1647 -1277 -2604 -885 -1293 -1667 -487 -176 289 90 128 -167 -262 -650 -488 280 496 912 1098 -76 145 -1275 -413 -641 58 -224 4 -659 801 1280 1084 1227 718 -113 -457 -274 -215 220 304 325 384 862 1348 671 1307 915 270 1337 1064 1518 333 -126 -470 965 -440 -110 -387 57 -866 -920 -876 -1282 -1592 SS 20220830T141737.6Z 8277.595574 104 1 9.78 2 60.58 96.79 99.08 89.61 0.00 1 0.00 1 0 17 1.640e-02 6.578e-03 7.826e-03 3.374e-03 2.534078e-01 1.716164e-03 2.801779e-03 -6.000000e+00 9.418206e-03 229.01 -2.00 3.24 -2.00 316.59 0.00e+00 1.592799e-04 2.152054e-04 4.197592e-05 -6.000000e+00 4.346722e-04 294.12 -2.00 20.00 -2.00 315.68 0.00e+00 2.027 0.000 302.00 328.00 3 4.6714e+00 4.4906e-03 2.3518e-02 -6.0000e+00 2.3375e-02 2.1086e-02 5.0435e-03 1.2105e-02 -6.0000e+00 2.5316e-02 -4.1327e-03 2.9238e-03 5.8723e-03 -6.0000e+00 1.5171e-02 -1.0286e-03 1.3897e-03 1.6234e-03 -6.0000e+00 6.4974e-03 4.8863e-04 1.9423e-04 9.6535e-05 1.9204e-05 -6.0000e+00 4.4669e-04 -5.7654e-03 3.5312e-05 12 9 1 12 1 1 25.28 24.68 0.37 -0.00577 -0.00431 4 6 1 5 0 1920.090 27.15 19.99 24.68 37.14 27.1 1017.04 -7293 4926 -2395 2506 -6614 -1933 2690 -1651 4679 -8172 -3770 2464 -3429 -3146 1018 211 1176 5 -308 1788 1328 1799 703 838 493 755 -1225 344 -1023 42 1773 3488 -198 -288 -2704 -897 -1203 1630 -167 -475 -902 -274 -150 -949 -56 -306 -861 -1512 182 -1067 1613 727 96 1042 568 616 1372 1065 621 569 459 321 701 1266 634 -19 -251 -927 433 1002 142 128 333 501 895 -471 -1324 -965 -999 -1172 -1168 -1354 -1477 -1417 -459 -773 -148 471 357 234 80 -186 186 -285 -399 867 324 761 477 -426 -83 -851 -682 -706 272 62 -297 -480 596 97 342 527 193 109 -637 162 -65 96 -379 -43 -516 -404 346 655 662 293 298 986 270 230 465 152 -431 356 -229 72 183 190 -311 250 -331 -595 -618 -1253 808 -418 386 -1006 -279 402 -286 834 -1671 -733 475 -776 -797 277 61 351 1 -99 581 436 587 238 297 183 286 -464 122 -348 14 625 1292 -80 -116 -1056 -347 -509 767 -91 -287 -576 -179 -100 -635 -38 -203 -566 -981 115 -690 1068 508 70 780 434 477 1068 828 478 439 364 268 616 1147 568 -16 -205 -755 369 922 138 127 330 482 817 -405 -1076 -764 -826 -1047 -1125 -1385 -1568 -1552 -522 -919 -180 582 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