File name: Pandora257s1_AustinTX_20240823_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240824T063714.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Paul Walter Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 257 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20240823_L1_smca1c2d20230110p1-8.txt Full location name: St. Edward's University Short location name: AustinTX Country of location: United States Location latitude [deg]: 30.2285 Location longitude [deg]: -97.7544 Location altitude [m]: 205 Local noon date: 20240823 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: OOB session based on clearance session 1 First and last pixel inside fitting window: 228 370 Nominal wavelengths inside fitting window [nm]: 305.0779 305.2183 305.3587 305.4991 305.6395 305.7799 305.9203 306.0607 306.2010 306.3413 306.4817 306.6220 306.7623 306.9026 307.0429 307.1832 307.3234 307.4637 307.6039 307.7442 307.8844 308.0246 308.1648 308.3050 308.4452 308.5854 308.7255 308.8657 309.0058 309.1459 309.2860 309.4261 309.5662 309.7063 309.8464 309.9865 310.1265 310.2665 310.4066 310.5466 310.6866 310.8266 310.9666 311.1065 311.2465 311.3865 311.5264 311.6663 311.8062 311.9461 312.0860 312.2259 312.3658 312.5057 312.6455 312.7854 312.9252 313.0650 313.2048 313.3446 313.4844 313.6242 313.7639 313.9037 314.0434 314.1832 314.3229 314.4626 314.6023 314.7420 314.8816 315.0213 315.1610 315.3006 315.4402 315.5799 315.7195 315.8591 315.9986 316.1382 316.2778 316.4173 316.5569 316.6964 316.8359 316.9754 317.1149 317.2544 317.3939 317.5334 317.6728 317.8123 317.9517 318.0911 318.2305 318.3699 318.5093 318.6487 318.7880 318.9274 319.0667 319.2061 319.3454 319.4847 319.6240 319.7633 319.9025 320.0418 320.1810 320.3203 320.4595 320.5987 320.7379 320.8771 321.0163 321.1555 321.2946 321.4338 321.5729 321.7121 321.8512 321.9903 322.1294 322.2685 322.4075 322.5466 322.6856 322.8247 322.9637 323.1027 323.2417 323.3807 323.5197 323.6587 323.7976 323.9366 324.0755 324.2144 324.3533 324.4922 324.6311 324.7700 324.9089 --------------------------------------------------------------------------------------- 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 20240823T124349.1Z 9001.530429 222 1 55.51 2 82.22 81.58 46.69 254.02 0.00 1 0.00 1 0 33 7.544e-01 5.273e-02 2.513e-01 1.226e-02 6.617222e-01 7.986343e-03 8.910887e-03 -6.000000e+00 5.018465e-01 229.25 -2.00 3.25 -2.00 321.69 0.00e+00 3.700979e-02 4.579584e-03 2.483486e-03 -6.000000e+00 3.444524e-02 293.21 -2.00 20.00 -2.00 321.06 0.00e+00 6.872 0.004 302.00 328.00 3 2.8435e+00 3.1671e-02 7.6160e-02 -6.0000e+00 1.2576e+00 1.2122e+00 4.3276e-02 4.8108e-02 -6.0000e+00 1.3795e+00 -1.5378e+00 3.0998e-02 3.5888e-02 -6.0000e+00 8.1625e-01 5.9872e-01 1.3246e-02 3.8630e-02 -6.0000e+00 3.4502e-01 1.5426e-05 -1.9179e-05 4.5829e-04 6.1448e-04 -6.0000e+00 2.8586e-02 2.8840e-02 -3.6053e-06 12 8 8 10 0 0 -9.13 28.57 1.04 0.02884 0.02870 23 2 1 5 0 2413.090 36.25 20.00 28.57 32.58 0.0 985.08 900000 900000 900000 900000 153639 900000 42527 -45499 -22646 900000 900000 -47882 900000 900000 900000 282480 900000 900000 900000 900000 900000 337394 900000 900000 900000 -81679 110192 900000 112114 900000 900000 900000 24109 175121 18062 900000 5540 95923 57509 900000 900000 272006 900000 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483 5005 6346 3016 8290 -6622 689 -3042 539 4502 -10382 2859 4322 -2438 797 4291 1429 -2089 -10234 -3137 5357 -539 3812 5441 -316 236 -9415 4128 8513 -9496 7922 -5258 378 -8831 -1368 238 350 7700 490 -6049 -7115 8610 667 -1662 -2826 -2479 519 -6092 867 -4657 3504 15617 -3492 2353 8421 -553 3337 526 -2145 1870 4846 4334 -2979 -4531 -4597 956 8045 7664 -5767 -5483 -3984 SS 20240823T130016.1Z 9001.541853 227 1 54.67 2 78.70 83.58 50.01 256.89 0.00 1 0.00 1 0 17 3.087e-01 8.800e-03 1.234e-01 1.863e-03 5.848837e-01 1.053055e-03 6.169170e-03 -6.000000e+00 1.971772e-01 229.25 -2.00 3.25 -2.00 320.47 0.00e+00 9.207070e-04 4.446080e-04 8.648558e-04 -6.000000e+00 9.456182e-03 293.21 -2.00 20.00 -2.00 319.70 0.00e+00 4.925 0.001 302.00 328.00 3 2.3345e+00 3.3718e-03 5.5690e-02 -6.0000e+00 4.8858e-01 -2.0076e-02 4.3353e-03 2.8760e-02 -6.0000e+00 5.2727e-01 -3.4716e-02 3.7433e-03 1.4441e-02 -6.0000e+00 3.1587e-01 2.9556e-03 1.8419e-03 4.3031e-03 -6.0000e+00 1.3150e-01 2.4016e-04 1.4795e-05 6.2179e-05 6.5766e-05 -6.0000e+00 1.1220e-02 2.9891e-02 -5.9526e-05 11 8 0 10 0 0 62.58 28.55 0.51 0.02989 0.03000 132 13 1 5 0 414.090 36.25 20.00 28.55 33.31 0.0 989.91 43689 -33371 -65877 900000 -108692 -76292 -56042 -92989 -114593 -72081 -28893 -83976 -35200 150437 99494 -29861 10917 78580 104444 10420 29948 -4319 75353 -1577 769 -53232 -21562 2139 -11352 8017 -4716 394 -13290 3563 -15333 47736 -9675 -7651 -5085 6814 1501 2738 8175 -7643 69 -7086 -1291 4945 -3714 4812 5767 10724 1482 7585 -4410 492 1448 397 580 910 -2109 1328 6740 -872 -2998 -1491 5130 1314 -77 78 1440 1767 303 738 1085 -762 1680 -2789 -1378 -2051 -1884 -1262 -2994 -813 721 13 135 1046 792 658 -953 123 46 618 432 973 -73 996 -167 -385 -116 -1525 302 -759 -148 -1610 -740 -430 -48 887 186 20 74 139 -158 140 108 391 247 -298 -305 -438 382 1077 -118 316 254 326 840 -62 -169 -229 -112 -27 -122 -160 -425 394 576 -103 -153 -118 -322 87 -160 -457 900000 -1149 -605 -398 -1075 -1836 -833 -268 -1587 -499 410 542 -689 188 757 835 225 555 -118 986 -48 25 -3046 -913 72 -452 287 -218 20 -848 202 -1078 1891 -768 -705 -544 751 195 378 1121 -1265 11 -1218 -215 800 -691 887 1157 2260 341 1768 -1228 136 406 113 164 259 -652 432 2292 -346 -1257 -618 2009 561 -37 41 740 939 162 409 556 -368 759 -1352 -726 -1144 -1203 -901 -2379 -628 586 11 122 964 728 585 -815 99 39 500 384 977 -78 1173 -211 -488 -140 -1742 323 -823 -167 -1956 -949 -552 -67 1339 287 31 118 217 -237 204 157 589 391 -491 -504 -710 596 1609 -183 473 377 502 1315 -108 -301 -437 -213 -54 -260 -340 -932 872 1267 -222 -315 -246 -661 SS 20240823T130543.5Z 9001.545643 230 1 54.68 2 77.53 84.24 51.12 257.79 0.00 1 0.00 1 0 17 1.764e-01 7.138e-03 3.332e-02 1.302e-03 5.411334e-01 7.249790e-04 5.738014e-03 -6.000000e+00 1.125784e-01 229.25 -2.00 3.25 -2.00 319.97 0.00e+00 2.207803e-04 2.577279e-04 8.287004e-04 -6.000000e+00 5.299318e-03 293.21 -2.00 20.00 -2.00 319.14 0.00e+00 4.497 0.001 302.00 328.00 3 2.1681e+00 2.1980e-03 5.1049e-02 -6.0000e+00 2.7912e-01 -2.7102e-02 2.7037e-03 2.6597e-02 -6.0000e+00 3.0119e-01 -2.6534e-02 2.1592e-03 1.2919e-02 -6.0000e+00 1.8048e-01 1.0634e-03 1.0895e-03 3.5145e-03 -6.0000e+00 7.5097e-02 4.4113e-04 1.2462e-04 4.3720e-05 5.3060e-05 -6.0000e+00 6.3741e-03 2.9350e-02 -3.8208e-05 11 8 0 10 0 0 14.59 28.55 0.38 0.02935 0.03029 192 19 1 5 0 284.760 36.25 20.00 28.55 33.49 0.0 991.84 -28845 -56999 -24677 -5644 -71771 -81526 -57732 -62434 -82541 -66418 -18325 -53968 -29581 11279 -4517 -9829 13117 -408 17636 -1880 7633 -4000 25872 -3736 -201 -25688 -12309 -7491 -3880 2223 -5389 -5049 -2552 -4576 -11456 18587 -6402 -1850 -4631 2159 715 -275 4297 -3104 -352 -5341 -834 2923 -1144 1866 3648 4208 1373 5013 -1100 1119 1470 216 453 232 -461 984 4297 584 -1127 -723 2494 1010 440 601 1188 1453 168 443 410 -411 719 -2183 -819 -1467 -1763 -867 -2740 -1207 -127 -104 126 688 602 450 -432 189 12 467 558 439 215 536 -81 -718 -235 -1085 -315 -217 -187 -1302 -832 -397 -61 677 364 38 -6 167 -61 -66 420 134 266 -88 -200 -163 558 567 155 403 97 409 615 79 -135 -128 -284 -167 -14 49 -197 250 425 -113 -224 -290 -286 -242 -702 -229 -43 -1048 -1356 -828 -1055 -1897 -1425 -270 -1316 -680 209 -116 -307 363 -14 544 -74 285 -175 890 -186 -10 -1778 -753 -437 -223 130 -381 -403 -218 -417 -1145 1452 -723 -236 -721 364 136 -52 804 -642 -72 -1170 -178 618 -263 446 935 1179 431 1629 -402 416 556 83 173 90 -189 431 1829 277 -560 -357 1194 511 244 369 724 917 106 268 249 -233 385 -1223 -495 -940 -1293 -655 -2306 -1075 -120 -97 123 682 595 430 -422 174 10 427 556 461 240 661 -100 -893 -295 -1284 -353 -245 -221 -1649 -1049 -534 -88 1005 553 60 -9 253 -94 -98 623 207 429 -140 -320 -257 895 876 231 579 138 601 977 131 -230 -233 -545 -321 -28 100 -415 535 904 -234 -448 -583 -565 SS 20240823T131052.9Z 9001.549223 233 1 54.73 2 76.42 84.87 52.17 258.63 0.00 1 0.00 1 0 17 1.214e-01 6.480e-03 1.582e-02 9.600e-04 5.044984e-01 5.317759e-04 5.407804e-03 -6.000000e+00 7.747316e-02 229.25 -2.00 3.25 -2.00 319.54 0.00e+00 9.260201e-04 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