File name: Pandora25s1_HoustonTX_20220916_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T155005.4Z 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_20220916_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: 20220916 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 20220916T130453.9Z 8294.545068 241 1 13.39 2 78.19 93.88 27.69 264.70 0.00 1 0.00 1 0 25 1.732e-01 6.386e-03 1.211e-01 3.216e-03 5.474433e-01 1.680506e-03 5.842474e-03 -6.000000e+00 1.003041e-01 228.46 -2.00 3.24 -2.00 320.16 0.00e+00 1.530686e-03 6.072113e-04 3.937043e-04 -6.000000e+00 4.656036e-03 293.48 -2.00 20.00 -2.00 319.35 0.00e+00 4.731 0.001 302.00 328.00 3 1.9664e+00 5.1412e-03 5.3818e-02 -6.0000e+00 2.4954e-01 1.3087e-02 6.4364e-03 2.6535e-02 -6.0000e+00 2.7083e-01 -6.8681e-03 5.5131e-03 1.3211e-02 -6.0000e+00 1.6088e-01 -4.9248e-03 2.8153e-03 4.1600e-03 -6.0000e+00 6.8499e-02 3.8009e-04 -4.6215e-04 9.0994e-05 4.5215e-05 -6.0000e+00 4.7990e-03 -3.9683e-03 4.6277e-05 12 1 1 12 1 1 19.95 24.57 0.28 -0.00397 -0.00744 24 20 1 5 0 528.480 27.05 20.00 24.57 33.07 27.1 993.85 100394 13348 -38594 -37806 -13685 -81993 900000 -87474 900000 -54765 -23058 -12127 -38202 -21477 -13943 -44376 -4434 22638 -7442 16195 -7889 9163 -42880 -795 -16812 13698 -17950 -2721 -4070 -21205 15540 -3600 6477 -5025 -258 3451 5251 8506 3995 -2381 -2393 3172 2062 1162 3215 6760 -1973 427 468 -1422 474 705 -797 3649 1765 1581 1800 -1999 -19 -638 1942 -470 1017 680 933 70 1198 -565 1523 605 144 183 -358 -54 1492 571 -2466 328 -1809 -137 -845 -391 -1548 -81 -857 -702 -227 -522 408 117 900 740 1643 -393 98 91 599 -317 411 -61 -377 -1063 -673 -638 -151 -695 -669 15 39 -44 97 493 453 246 153 -45 381 -383 206 -2 -275 -103 94 -64 475 71 -296 1099 150 203 344 -28 -525 234 -142 -12 -258 183 -52 -124 -104 54 -113 315 84 -427 -393 -104 -1195 900000 -1741 900000 -953 -307 -167 -856 -512 -378 -1808 -134 603 -274 498 -316 313 -2517 -35 -903 599 -1033 -136 -204 -1314 821 -257 475 -428 -20 264 447 848 491 -368 -411 550 378 210 604 1252 -388 84 96 -317 115 190 -228 1079 560 523 610 -699 -6 -214 667 -183 424 313 438 32 530 -262 745 343 86 114 -220 -32 807 292 -1217 160 -972 -85 -589 -296 -1240 -68 -776 -656 -222 -508 404 111 818 627 1366 -331 91 91 665 -390 522 -76 -458 -1212 -736 -716 -176 -837 -851 20 54 -65 154 807 733 381 229 -67 564 -583 322 -3 -452 -164 149 -97 710 103 -426 1572 234 343 598 -52 -989 452 -287 -26 -550 396 -114 -259 -211 106 -217 SS 20220916T131000.0Z 8294.548611 244 1 13.21 2 77.09 94.53 28.77 265.50 0.00 1 0.00 1 0 25 2.804e-01 7.027e-03 1.212e-01 3.245e-03 5.073225e-01 1.667085e-03 5.441143e-03 -6.000000e+00 1.606689e-01 228.46 -2.00 3.24 -2.00 319.80 0.00e+00 1.777844e-03 5.326060e-04 2.023652e-04 -6.000000e+00 7.412962e-03 293.48 -2.00 20.00 -2.00 318.95 0.00e+00 4.355 0.001 302.00 328.00 3 2.3742e+00 4.9166e-03 4.9638e-02 -6.0000e+00 3.9831e-01 2.1454e-02 5.9894e-03 2.4625e-02 -6.0000e+00 4.3166e-01 -5.2756e-03 4.8594e-03 1.2120e-02 -6.0000e+00 2.5869e-01 -5.0749e-03 2.5242e-03 4.0063e-03 -6.0000e+00 1.1081e-01 3.7316e-04 -5.3493e-04 9.1933e-05 4.1803e-05 -6.0000e+00 7.6384e-03 -3.4858e-03 2.9918e-05 12 9 1 12 1 1 76.36 24.58 0.28 -0.00349 -0.00751 18 15 1 5 0 685.610 27.05 19.99 24.58 33.21 27.1 994.73 275448 -5170 -14388 -3296 -50431 -56161 81982 -45713 85417 -30748 -49369 -16311 -27948 -5493 -19645 -41744 -2134 13213 -6366 21326 -4016 -1577 -18982 -2458 -7578 -8610 -10542 -18978 -2638 -12153 15428 5346 7093 -1700 -3181 -1552 1237 11333 -318 -3121 -909 1541 -575 -513 1609 1464 -2800 -1158 3740 -2015 1426 272 -801 1901 1646 2523 2810 -1620 2338 -667 2351 539 1686 1001 439 234 123 -254 240 1110 816 1059 287 -29 1233 595 -2448 -682 -745 -285 -1198 -1506 -1383 -637 -756 -1243 103 -314 857 959 670 446 426 -114 225 854 582 574 201 -355 -506 -948 -1130 -1134 -323 -675 -921 -806 -40 -187 518 116 449 69 191 78 57 -398 93 -172 -464 147 498 285 293 967 222 742 526 350 399 175 49 126 -70 -218 -134 72 -288 -327 87 -255 -262 872 -61 -194 -38 -851 -1019 445 -955 579 -662 -1333 -361 -807 -158 -789 -2411 -91 528 -331 886 -219 -85 -1292 -155 -540 -612 -765 -1438 -178 -916 1089 455 669 -180 -326 -160 140 1397 -51 -605 -190 335 -133 -121 377 350 -705 -292 927 -562 402 86 -277 687 626 987 1122 -671 910 -267 958 235 814 533 239 122 63 -133 133 694 533 715 192 -20 743 341 -1351 -373 -432 -192 -896 -1215 -1204 -582 -712 -1255 104 -325 874 974 634 410 373 -103 213 882 662 708 266 -466 -620 -1099 -1279 -1319 -388 -858 -1190 -1107 -57 -283 816 189 722 110 283 115 84 -600 149 -279 -755 231 782 432 441 1385 320 1061 805 573 683 316 89 241 -139 -443 -278 152 -594 -672 173 -487 -503 SS 20220916T131446.7Z 8294.551930 247 1 49.49 2 76.05 95.15 29.78 266.23 0.00 1 0.00 1 0 25 5.958e-02 4.676e-03 8.276e-03 5.658e-04 4.749415e-01 2.888582e-04 5.101744e-03 -6.000000e+00 3.414257e-02 228.46 -2.00 3.24 -2.00 319.45 0.00e+00 8.618493e-04 8.213308e-05 1.698159e-04 -6.000000e+00 1.575064e-03 293.48 -2.00 20.00 -2.00 318.56 0.00e+00 4.054 0.001 302.00 328.00 3 6.9458e-01 8.2999e-04 4.6251e-02 -6.0000e+00 8.4643e-02 -2.5964e-03 9.8909e-04 2.2956e-02 -6.0000e+00 9.1726e-02 -3.7006e-03 7.5577e-04 1.1160e-02 -6.0000e+00 5.4971e-02 -4.5147e-03 3.9712e-04 3.3203e-03 -6.0000e+00 2.3548e-02 2.8112e-03 -2.7542e-04 1.6020e-05 3.4514e-05 -6.0000e+00 1.6229e-03 -3.5679e-03 5.3280e-05 10 0 0 10 0 0 69.32 24.58 0.25 -0.00357 -0.00564 536 114 1 5 0 92.320 27.05 19.99 24.58 33.42 27.2 996.17 -45487 -6226 -19479 -10201 -27670 -14890 -15287 -14829 -5222 -12755 -16470 -9428 -5449 -5816 -2913 -1306 -283 -2146 268 -2613 -1221 -4121 -3618 -2769 -3038 -1610 -3760 -2254 -3890 -2365 -613 1738 -58 -433 -3552 -1879 -3139 -503 -744 -1056 -851 -433 145 -459 423 57 -342 -810 -57 -459 923 846 967 1232 982 1074 739 481 218 657 553 1088 1221 1865 911 291 137 -293 549 426 412 467 352 292 468 -103 -745 -1072 -564 -668 -813 -1055 -1591 -1362 -1066 -470 -157 275 548 719 675 607 341 297 250 266 379 511 148 -293 -328 -759 -558 -440 -651 -1018 -597 -559 -168 286 284 184 310 193 -91 149 70 -43 -116 -91 -406 -89 85 271 391 355 263 834 548 505 237 -30 -7 -2 94 -74 -132 102 -131 -212 -153 -187 -273 -1093 -113 -418 -187 -558 -268 -307 -342 -123 -344 -478 -288 -195 -235 -137 -69 -16 -135 18 -186 -87 -306 -284 -235 -278 -152 -363 -204 -351 -224 -65 208 -7 -56 -453 -240 -459 -86 -157 -243 -215 -116 40 -130 120 16 -100 -240 -17 -147 320 323 372 508 425 482 340 221 98 294 259 558 655 1083 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