File name: Pandora25s1_HoustonTX_20231101_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20240927T230204.3Z 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_20231101_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: 20231101 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 20231101T132357.4Z 8705.558303 261 1 49.54 2 80.77 112.58 53.67 284.20 0.00 1 0.00 1 0 25 3.522e-01 5.848e-03 1.273e-01 1.691e-03 6.740089e-01 9.099560e-04 7.086183e-03 -6.000000e+00 2.026957e-01 225.92 -2.00 3.24 -2.00 321.07 0.00e+00 1.394954e-03 4.476314e-04 4.667663e-04 -6.000000e+00 9.253167e-03 289.83 -2.00 20.00 -2.00 320.43 0.00e+00 5.920 0.002 302.00 328.00 3 6.6203e-01 3.1494e-03 6.7085e-02 -6.0000e+00 5.0062e-01 -4.4830e-03 4.3948e-03 3.3188e-02 -6.0000e+00 5.4395e-01 -6.5877e-03 4.4093e-03 1.7356e-02 -6.0000e+00 3.2470e-01 -7.2787e-03 2.1069e-03 5.8267e-03 -6.0000e+00 1.3996e-01 4.0892e-04 -5.1436e-04 4.6863e-05 6.5007e-05 -6.0000e+00 9.7556e-03 -2.7580e-02 1.6778e-04 10 0 0 10 0 0 69.26 23.97 0.31 -0.02758 -0.03145 232 49 1 5 0 213.510 26.51 20.00 23.97 11.97 29.0 981.39 900000 -99817 -168233 -79197 -149435 -149864 900000 -131988 92293 -66838 -137531 -46205 -102939 -34918 -65087 900000 -24679 33075 -22574 -1905 -19822 -25845 -19486 -28352 -16660 1530 -16281 -29026 -12656 -29296 -2750 -5732 -6600 -7601 -14344 -2763 -2919 25587 -2771 -2900 -3238 4988 -5308 4781 1120 867 -3243 433 4805 576 4377 603 2253 1751 1674 2116 3469 -1857 2151 -452 1450 -827 954 1768 869 1609 757 143 1016 2035 1093 723 679 1129 1030 -405 -2433 -1368 -269 -878 -902 -1558 -1436 -1236 -1050 -1106 -222 330 576 949 830 605 255 208 -511 217 311 687 216 -85 -239 -611 -874 -918 -963 -1038 -786 -915 -287 1821 336 276 680 349 53 338 58 -185 -470 -378 -486 71 87 67 104 425 -13 436 443 0 183 -107 -52 -25 -287 -152 -191 282 16 74 50 -181 -16 900000 -392 -1429 -271 -966 -988 900000 -954 152 -322 -1448 -229 -1162 -261 -842 900000 -297 252 -329 -24 -312 -439 -334 -593 -342 28 -367 -677 -270 -755 -66 -172 -235 -294 -578 -100 -119 946 -170 -201 -257 395 -494 415 103 82 -331 45 502 68 563 85 348 299 306 406 681 -385 418 -89 291 -188 244 510 268 486 229 45 336 771 464 323 300 471 394 -141 -813 -461 -101 -396 -479 -904 -918 -841 -764 -816 -171 261 454 721 623 427 175 147 -387 190 299 757 250 -99 -277 -641 -884 -927 -992 -1137 -907 -1081 -369 2582 514 432 1071 560 81 494 85 -283 -767 -616 -789 115 137 102 152 628 -19 643 701 0 334 -211 -108 -54 -626 -350 -453 677 39 172 110 -391 -32 SS 20231101T133431.5Z 8705.565643 266 1 49.45 2 78.67 114.05 55.83 285.06 0.00 1 0.00 1 0 25 1.725e-01 5.236e-03 3.039e-02 8.626e-04 5.721467e-01 4.465867e-04 6.104056e-03 -6.000000e+00 9.823769e-02 225.92 -2.00 3.24 -2.00 320.30 0.00e+00 1.185708e-03 1.706517e-04 4.284637e-04 -6.000000e+00 4.490460e-03 289.83 -2.00 20.00 -2.00 319.57 0.00e+00 4.914 0.001 302.00 328.00 3 5.1644e-01 1.3730e-03 5.5963e-02 -6.0000e+00 2.4245e-01 -1.9421e-03 1.7406e-03 2.7935e-02 -6.0000e+00 2.6303e-01 -5.0833e-03 1.5733e-03 1.3815e-02 -6.0000e+00 1.5761e-01 -7.1950e-03 7.9722e-04 4.6793e-03 -6.0000e+00 6.7932e-02 1.3366e-03 -2.2318e-04 2.4130e-05 4.7394e-05 -6.0000e+00 4.6871e-03 -2.7925e-02 1.7712e-04 10 0 0 10 0 0 53.95 23.95 0.32 -0.02792 -0.02960 441 94 1 5 0 112.110 26.51 20.00 23.95 12.86 29.4 987.55 -143837 -9406 -67612 -9773 -68968 -40680 -24091 -43713 -10223 -36957 -26156 -39632 -22060 -26813 -5428 16787 1537 -8073 -765 -9269 -4178 -7997 -4826 -6769 -10727 -4180 -8016 -5882 -11353 -1627 -5412 5459 -1473 393 -7071 -2280 -4060 1086 -2460 -1751 -377 -1510 566 -530 1661 56 717 -819 1358 -230 1412 892 930 1661 842 1342 857 847 117 753 17 1380 1330 1998 1164 752 200 -539 601 461 736 586 686 236 595 -374 -906 -1388 -750 -780 -967 -907 -1657 -1460 -1247 -506 -311 448 396 1100 815 1026 401 491 174 170 299 464 237 -97 -5 -758 -410 -577 -667 -1045 -655 -786 -250 681 225 299 285 366 -56 185 -55 -87 -215 -183 -527 -256 -43 169 264 444 175 591 623 290 444 -23 -24 88 -85 -90 -216 67 -41 -94 -75 -92 -163 -2651 -58 -724 -62 -670 -329 -182 -425 -89 -418 -280 -552 -322 -521 -106 311 37 -237 -23 -317 -140 -281 -175 -275 -495 -192 -390 -272 -544 -76 -283 302 -101 28 -523 -161 -326 99 -288 -226 -54 -235 91 -88 274 10 124 -149 251 -46 309 219 250 482 243 402 266 263 36 226 5 470 513 854 524 330 86 -240 292 241 424 354 411 135 311 -191 -432 -667 -396 -452 -654 -653 -1317 -1230 -1056 -456 -294 434 384 1023 710 882 331 412 152 170 325 544 303 -125 -6 -882 -437 -620 -774 -1291 -804 -1031 -354 1009 350 491 468 577 -88 275 -83 -135 -338 -302 -878 -414 -67 267 399 645 258 845 987 492 784 -44 -45 175 -173 -194 -461 144 -89 -207 -156 -191 -325 SS 20231101T134038.2Z 8705.569887 269 1 49.48 2 77.46 114.93 57.07 285.57 0.00 1 0.00 1 0 25 9.490e-02 4.714e-03 1.494e-02 6.461e-04 5.273842e-01 3.313133e-04 5.688712e-03 -6.000000e+00 5.405114e-02 225.92 -2.00 3.24 -2.00 319.89 0.00e+00 1.176417e-03 1.093512e-04 3.035389e-04 -6.000000e+00 2.470750e-03 289.83 -2.00 20.00 -2.00 319.11 0.00e+00 4.476 0.001 302.00 328.00 3 4.6131e-01 9.7700e-04 5.1098e-02 -6.0000e+00 1.3340e-01 -3.4054e-03 1.1960e-03 2.5569e-02 -6.0000e+00 1.4472e-01 -8.9968e-04 1.0131e-03 1.2600e-02 -6.0000e+00 8.6717e-02 -8.2261e-03 5.2641e-04 4.1196e-03 -6.0000e+00 3.7376e-02 2.2326e-03 -2.0278e-04 1.8171e-05 4.2444e-05 -6.0000e+00 2.5791e-03 -2.7926e-02 1.6188e-04 10 0 0 10 0 0 41.33 23.95 0.26 -0.02793 -0.02945 580 123 1 5 0 85.290 26.51 19.99 23.95 13.35 29.2 989.58 -47286 -28478 -34565 -33599 -38762 -37096 -22629 -31153 -17720 -22087 -21211 -15623 -22036 -9944 -11221 546 -4576 -1795 -3564 -2791 -2162 -4854 -3418 -2709 -4627 -2537 -3699 -4288 -5833 -4612 -1244 -1294 628 -1726 -4093 -4286 -3970 -832 -1454 -1067 -1356 -404 -893 -154 738 566 -215 -395 273 11 858 1091 1148 1316 714 927 845 238 450 12 508 681 1294 1844 1281 751 -9 -205 420 579 494 540 409 360 246 -38 -989 -888 -791 -641 -919 -901 -1538 -1468 -1050 -651 -124 191 707 929 984 813 440 528 276 267 151 511 232 -131 -208 -702 -653 -492 -834 -958 -726 -543 -281 598 248 196 223 281 104 138 77 -61 -157 -277 -522 -289 -61 252 328 495 115 734 565 366 372 96 -23 47 -25 -11 -202 114 -74 -181 -133 -159 -162 -588 -338 -463 -429 -480 -450 -288 -453 -257 -362 -360 -281 -521 -261 -366 19 -182 -76 -152 -125 -99 -230 -168 -145 -275 -156 -234 -263 -355 -294 -89 -108 59 -175 -407 -427 -439 -107 -213 -186 -265 -84 -195 -34 165 129 -50 -94 67 3 225 317 364 451 260 351 330 93 172 5 199 293 580 911 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