File name: Pandora257s1_AustinTX_20251014_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20251015T133801.5Z 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 v1.8.75 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20251014_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: 20251014 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 20251014T135056.0Z 9418.577037 6 1 54.73 2 74.49 109.67 10.30 229.94 0.00 1 0.00 1 0 25 3.949e-02 5.841e-03 1.861e-03 3.174e-04 4.121473e-01 1.733632e-04 4.481806e-03 -6.000000e+00 2.499627e-02 226.90 -2.00 3.25 -2.00 318.30 0.00e+00 9.412403e-04 3.542492e-05 2.941981e-04 -6.000000e+00 1.171370e-03 290.11 -2.00 20.00 -2.00 317.43 0.00e+00 3.671 0.001 302.00 328.00 3 4.7279e-01 4.6926e-04 4.0676e-02 -6.0000e+00 6.1695e-02 -5.0245e-03 5.3513e-04 1.9663e-02 -6.0000e+00 6.6716e-02 -2.4149e-02 3.4045e-04 9.5995e-03 -6.0000e+00 3.9977e-02 6.7758e-03 1.7136e-04 2.7847e-03 -6.0000e+00 1.6659e-02 5.9131e-03 -6.9786e-05 1.0960e-05 3.9818e-05 -6.0000e+00 1.4259e-03 2.6161e-02 -9.0849e-05 10 0 0 10 0 0 13.86 25.86 0.28 0.02616 0.02564 1324 128 1 5 0 41.330 33.75 20.01 25.86 30.91 0.0 962.92 -14619 -11833 -14061 -14533 -16767 -15751 -13618 -11917 -9793 -11710 -8362 -9327 -5500 -2168 -1981 -1255 14 -72 390 1033 368 -290 1084 347 -221 -840 -1377 -2012 -1342 6 234 133 382 -1405 -3007 -1361 -1182 -418 66 -44 -205 12 144 113 209 460 47 292 289 643 1355 1201 1060 1451 891 809 967 571 406 742 1167 1640 1575 1318 312 -277 425 399 941 1044 363 108 -112 8 -328 -574 -503 -752 -596 -686 -1420 -1593 -1896 -1664 -1001 -650 -277 -126 221 201 139 336 136 298 640 386 140 319 -87 -632 -566 -530 -501 38 -195 -1084 -760 -400 -131 285 343 129 65 153 67 277 503 410 308 177 -196 -38 454 351 461 611 372 836 902 221 84 -115 -206 -66 41 -52 -250 168 142 -354 -292 -339 -543 -705 -603 -748 -759 -870 -818 -742 -703 -617 -805 -598 -752 -496 -222 -213 -150 2 -10 56 154 57 -46 178 61 -41 -161 -266 -385 -255 1 50 29 88 -339 -746 -346 -333 -126 23 -16 -85 5 65 49 91 202 21 130 131 305 683 615 583 843 512 480 583 346 245 452 739 1050 1092 968 222 -194 306 294 703 813 307 90 -94 7 -258 -439 -362 -541 -458 -563 -1258 -1496 -1853 -1735 -1061 -700 -311 -145 252 221 150 355 138 303 665 428 168 403 -113 -816 -722 -660 -598 46 -238 -1414 -1008 -542 -184 412 526 196 97 227 97 399 722 589 451 271 -306 -58 677 523 656 864 517 1179 1309 337 132 -186 -347 -114 72 -93 -462 315 266 -653 -534 -598 -947 SS 20251014T135602.6Z 9418.580585 9 1 54.70 2 73.45 110.42 11.16 234.03 0.00 1 0.00 1 0 25 2.851e-02 5.786e-03 1.333e-03 2.779e-04 3.900967e-01 1.516876e-04 4.252688e-03 -6.000000e+00 1.804480e-02 226.90 -2.00 3.25 -2.00 318.03 0.00e+00 8.083373e-04 2.860204e-05 2.346950e-04 -6.000000e+00 8.456368e-04 290.11 -2.00 20.00 -2.00 317.15 0.00e+00 3.455 0.000 302.00 328.00 3 4.5011e-01 4.0727e-04 3.8324e-02 -6.0000e+00 4.4538e-02 -6.3436e-03 4.6163e-04 1.8564e-02 -6.0000e+00 4.8163e-02 -1.8772e-02 2.8468e-04 9.0372e-03 -6.0000e+00 2.8860e-02 4.2668e-03 1.4162e-04 2.5826e-03 -6.0000e+00 1.2025e-02 7.5978e-03 -9.5393e-05 9.6335e-06 3.7519e-05 -6.0000e+00 1.0294e-03 2.6638e-02 -8.2128e-05 10 0 0 10 0 0 18.21 26.32 0.29 0.02664 0.02592 1498 145 1 5 0 36.510 34.50 20.00 26.32 31.10 0.0 963.88 -9939 -9860 -8872 -10756 -13435 -11478 -8311 -7758 -6253 -8142 -7189 -5510 -4073 -1235 -837 -962 -786 1016 563 1511 736 -45 1203 802 -67 -266 -896 -1041 -1015 324 364 233 228 -1228 -2927 -1168 -1066 -334 43 -89 -439 -253 -31 -248 120 265 -130 148 59 507 1204 1141 998 1308 761 793 850 431 396 739 1234 1725 1612 1473 388 -161 156 248 833 1014 260 84 -42 21 -181 -442 -483 -778 -570 -728 -1437 -1532 -1885 -1668 -924 -650 -352 -154 193 305 160 360 162 365 614 402 190 288 -72 -581 -582 -553 -566 50 -245 -1091 -797 -406 -143 312 370 158 83 108 62 287 487 368 335 206 -160 -71 389 335 448 630 289 785 942 291 114 -92 -214 -41 90 -51 -203 151 95 -404 -327 -348 -538 -602 -645 -585 -705 -876 -741 -556 -567 -490 -694 -650 -544 -415 -143 -111 -142 -126 170 99 275 139 -9 241 156 -14 -57 -191 -218 -212 69 84 59 62 -349 -787 -321 -325 -117 16 -36 -197 -120 -14 -117 57 126 -62 71 29 257 647 622 583 807 465 499 543 277 253 477 827 1170 1180 1082 290 -119 112 181 648 823 219 74 -36 18 -148 -351 -360 -579 -452 -615 -1311 -1481 -1898 -1719 -1009 -722 -393 -176 220 347 172 374 167 379 650 454 231 357 -94 -761 -728 -673 -686 61 -304 -1398 -1041 -560 -203 458 557 243 125 162 88 401 677 529 491 307 -243 -107 585 486 642 893 402 1106 1363 442 179 -147 -348 -69 156 -91 -363 275 173 -722 -578 -611 -933 SS 20251014T140118.9Z 9418.584246 12 1 54.71 2 72.39 111.21 12.09 237.66 0.00 1 0.00 1 0 25 2.152e-02 5.799e-03 9.752e-04 2.455e-04 3.684648e-01 1.342563e-04 4.027389e-03 -6.000000e+00 1.362296e-02 226.90 -2.00 3.25 -2.00 317.74 0.00e+00 8.068707e-04 2.325452e-05 1.790960e-04 -6.000000e+00 6.384267e-04 290.11 -2.00 20.00 -2.00 316.86 0.00e+00 3.259 0.000 302.00 328.00 3 4.2100e-01 3.5758e-04 3.6148e-02 -6.0000e+00 3.3624e-02 -8.6195e-03 4.0403e-04 1.7514e-02 -6.0000e+00 3.6361e-02 -1.5568e-02 2.4379e-04 8.5346e-03 -6.0000e+00 2.1788e-02 3.4169e-03 1.1907e-04 2.4510e-03 -6.0000e+00 9.0783e-03 9.6629e-03 -8.2645e-05 8.5608e-06 3.5891e-05 -6.0000e+00 7.7716e-04 2.7169e-02 -6.9212e-05 10 0 0 10 0 0 41.10 26.72 0.30 0.02717 0.02655 1712 165 1 5 0 31.950 35.00 20.00 26.72 31.17 0.0 963.95 -6637 -7574 -6815 -8324 -9465 -8283 -6582 -5288 -4466 -6303 -6094 -3572 -2591 -823 225 -378 -83 1118 722 1762 1081 634 1130 1009 -16 -365 -1013 -745 -637 787 1042 611 509 -1212 -2677 -1217 -1034 -529 120 -106 -599 -438 -163 -251 -10 241 -155 155 3 404 1024 1067 884 1106 578 770 936 509 506 877 1200 1584 1546 1369 253 -223 161 100 849 853 289 48 -132 82 -105 -461 -482 -717 -437 -762 -1378 -1532 -1909 -1725 -952 -686 -270 -65 237 256 162 359 171 333 678 494 228 366 -30 -584 -614 -617 -585 25 -257 -1089 -780 -443 -139 313 394 215 119 63 25 270 460 342 336 223 -163 -64 391 327 409 670 327 799 970 253 76 -71 -233 -25 90 -40 -211 146 117 -409 -280 -370 -588 -505 -627 -568 -685 -761 -663 -552 -481 -437 -668 -624 -394 -324 -117 36 -68 -15 208 142 355 225 136 250 236 -4 -93 -259 -186 -157 198 281 167 148 -369 -832 -387 -338 -200 49 -46 -290 -224 -81 -127 -5 123 -79 79 1 217 582 615 545 681 373 510 628 343 340 594 845 1131 1131 1055 198 -171 119 76 682 717 252 43 -120 71 -89 -377 -370 -548 -354 -658 -1284 -1453 -1965 -1821 -1024 -754 -310 -76 276 288 178 381 173 350 726 563 270 458 -38 -747 -774 -758 -690 30 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