File name: Pandora88s1_SanAntonioTX_20250403_L2Fit_fout2c2d20240901p1-8.txt File generation date: 20250504T101735.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 88 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora88_OF_v2d20240227.txt Instrument calibration file used: Pandora88s1_CF_v2d20240901.txt Level 1 file used: Pandora88s1_SanAntonioTX_20250403_L1_smca1c2d20240901p1-8.txt Full location name: University of Texas San Antonio Downtown Campus Short location name: SanAntonioTX Country of location: USA Location latitude [deg]: 29.4229 Location longitude [deg]: -98.5025 Location altitude [m]: 230 Local noon date: 20250403 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: 198 340 Nominal wavelengths inside fitting window [nm]: 305.0435 305.1841 305.3247 305.4653 305.6059 305.7464 305.8870 306.0275 306.1680 306.3086 306.4491 306.5895 306.7300 306.8705 307.0110 307.1514 307.2918 307.4323 307.5727 307.7131 307.8535 307.9939 308.1342 308.2746 308.4150 308.5553 308.6956 308.8359 308.9762 309.1165 309.2568 309.3971 309.5373 309.6776 309.8178 309.9581 310.0983 310.2385 310.3787 310.5189 310.6590 310.7992 310.9393 311.0795 311.2196 311.3597 311.4998 311.6399 311.7800 311.9201 312.0601 312.2002 312.3402 312.4803 312.6203 312.7603 312.9003 313.0403 313.1802 313.3202 313.4601 313.6001 313.7400 313.8799 314.0198 314.1597 314.2996 314.4395 314.5793 314.7192 314.8590 314.9988 315.1386 315.2785 315.4182 315.5580 315.6978 315.8376 315.9773 316.1170 316.2568 316.3965 316.5362 316.6759 316.8155 316.9552 317.0949 317.2345 317.3741 317.5138 317.6534 317.7930 317.9326 318.0721 318.2117 318.3513 318.4908 318.6303 318.7699 318.9094 319.0489 319.1884 319.3278 319.4673 319.6067 319.7462 319.8856 320.0250 320.1644 320.3038 320.4432 320.5826 320.7220 320.8613 321.0006 321.1400 321.2793 321.4186 321.5579 321.6972 321.8364 321.9757 322.1149 322.2542 322.3934 322.5326 322.6718 322.8110 322.9502 323.0893 323.2285 323.3676 323.5068 323.6459 323.7850 323.9241 324.0632 324.2023 324.3413 324.4804 324.6194 324.7585 324.8975 --------------------------------------------------------------------------------------- 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 20250403T142724.6Z 9224.602368 96 1 8.31 2 63.35 99.13 108.13 41.40 0.00 1 0.00 1 0 17 1.162e-02 6.349e-03 4.986e-03 2.139e-03 2.654874e-01 1.067181e-03 2.934298e-03 -6.000000e+00 6.507507e-03 228.39 -2.00 3.23 -2.00 316.52 0.00e+00 8.357270e-04 1.279587e-04 6.234503e-05 -6.000000e+00 2.898255e-04 286.19 -2.00 20.00 -2.00 315.77 0.00e+00 2.217 0.000 302.00 328.00 3 3.5532e+00 2.7833e-03 2.4962e-02 -6.0000e+00 1.6190e-02 -6.1005e-03 3.1124e-03 1.2618e-02 -6.0000e+00 1.7544e-02 6.6395e-03 1.8196e-03 6.1523e-03 -6.0000e+00 1.0461e-02 -4.5399e-03 8.7917e-04 1.8148e-03 -6.0000e+00 4.5225e-03 1.2820e-03 1.7190e-04 5.6406e-05 1.8176e-05 -6.0000e+00 2.8809e-04 7.5657e-03 0.0000e+00 12 1 1 12 1 1 99.98 25.37 0.30 0.00757 0.00886 14 11 1 5 0 553.900 33.75 20.00 25.37 30.57 0.0 1001.84 -2366 -1556 1190 132 -6484 -371 853 -2938 -479 -2901 -1839 -2509 -2345 -1615 -671 1379 -1316 320 411 1591 2837 633 1394 765 897 1483 1024 514 -117 618 482 1003 2098 706 -2796 -2580 -1671 -790 75 -232 -197 -724 -287 -1809 -919 -446 -313 -310 -1338 -586 1052 17 1045 868 611 931 1179 1035 423 -480 859 1300 1250 1920 1152 231 -395 -850 -506 242 439 -13 71 1157 108 -734 -708 -1772 -669 -924 -1137 -1253 -1557 -1500 -244 -759 -280 164 244 698 645 355 -249 -467 -27 279 345 820 583 204 -291 -651 -1226 -660 -216 -676 -319 -484 -285 119 905 567 599 218 105 -192 -50 -43 152 246 27 -10 400 114 367 95 205 672 94 50 242 -131 -393 -447 -26 34 -105 173 363 -91 53 -419 -496 -371 -267 206 22 -986 -51 123 -490 -88 -582 -356 -493 -524 -379 -179 405 -413 103 138 506 914 204 455 269 329 564 398 189 -40 221 171 380 862 312 -1176 -1029 -729 -364 39 -134 -126 -454 -186 -1209 -604 -294 -203 -208 -891 -384 717 12 764 638 468 720 933 821 330 -373 675 1035 1086 1705 1050 205 -326 -680 -417 216 414 -13 71 1113 103 -669 -579 -1446 -551 -821 -1086 -1270 -1636 -1631 -269 -870 -337 204 297 855 762 403 -259 -480 -29 315 412 1008 751 272 -367 -797 -1445 -778 -268 -862 -422 -650 -400 170 1325 855 880 311 143 -252 -64 -57 209 351 40 -15 574 158 496 128 262 866 126 70 340 -192 -586 -658 -40 54 -167 282 604 -149 85 -661 -782 SS 20250403T144321.1Z 9224.613439 108 1 3.22 2 59.93 101.42 105.88 43.98 0.00 1 0.00 1 0 17 9.920e-03 7.085e-03 4.110e-03 2.273e-03 2.438011e-01 1.139838e-03 2.709082e-03 -6.000000e+00 5.557622e-03 228.39 -2.00 3.23 -2.00 315.83 0.00e+00 5.169173e-04 1.167012e-04 5.582279e-05 -6.000000e+00 2.474967e-04 286.20 -2.00 20.00 -2.00 315.11 0.00e+00 1.987 0.000 302.00 328.00 3 2.9729e+00 2.9466e-03 2.2511e-02 -6.0000e+00 1.3827e-02 7.3898e-03 3.2865e-03 1.1529e-02 -6.0000e+00 1.4983e-02 -1.1163e-03 1.8956e-03 5.6256e-03 -6.0000e+00 8.9341e-03 -2.5178e-03 8.8220e-04 1.6014e-03 -6.0000e+00 3.8627e-03 2.9421e-03 1.1567e-04 5.9769e-05 1.7260e-05 -6.0000e+00 2.4601e-04 6.7758e-03 0.0000e+00 12 9 1 12 1 1 98.71 25.40 0.29 0.00678 0.00764 8 17 1 5 0 356.720 33.75 20.00 25.40 30.99 0.0 1003.43 -1111 329 -2146 -3413 -2134 -1156 -2436 -434 -511 246 -1211 -1354 -1170 -1299 241 732 253 916 1376 726 1434 817 1459 1015 454 153 379 -252 -943 175 901 1320 2268 66 -2688 -2655 -2017 -1811 -1059 686 179 -328 201 -1021 -484 -572 -251 -363 -1062 -816 739 343 1332 1336 1121 1000 625 96 674 51 451 1160 1600 1663 1509 -261 -405 -1077 -256 574 321 625 148 857 467 -291 -913 -2072 -1103 -814 -1384 -1312 -1858 -2112 -1044 -117 -81 -286 623 762 379 93 -311 -484 -116 -80 447 917 730 283 -97 -615 -1058 -970 -549 -647 -455 -387 -233 275 485 811 599 255 49 -586 -30 60 -141 478 100 118 432 575 631 456 -73 265 787 139 215 -163 39 -375 -238 3 -240 263 208 -145 180 -609 -839 -262 77 -534 -809 -465 -237 -538 -105 -128 65 -316 -355 -345 -407 85 267 96 357 554 305 575 345 621 434 204 71 180 -113 -413 74 378 586 1086 32 -1313 -1229 -962 -987 -617 445 122 -234 147 -734 -360 -427 -183 -258 -742 -561 527 253 1020 1037 905 817 525 81 553 42 375 983 1410 1581 1403 -234 -349 -938 -218 534 320 629 151 841 449 -263 -775 -1728 -925 -737 -1311 -1328 -1970 -2323 -1174 -137 -97 -354 778 925 440 102 -335 -491 -122 -90 514 1136 952 367 -123 -752 -1236 -1139 -664 -807 -589 -512 -320 388 707 1176 870 358 64 -740 -39 77 -188 663 141 168 607 801 852 589 -92 336 1027 189 299 -231 55 -534 -351 4 -375 419 330 -232 276 -939 -1253 SS 20250403T150619.4Z 9224.629391 127 1 25.84 2 55.06 104.96 102.46 47.46 0.00 1 0.00 1 0 17 8.866e-03 6.426e-03 4.541e-04 2.933e-04 2.134908e-01 1.478121e-04 2.382117e-03 -6.000000e+00 4.967372e-03 228.39 -2.00 3.23 -2.00 315.25 0.00e+00 4.829442e-04 1.339521e-05 2.293871e-05 -6.000000e+00 2.211942e-04 286.20 -2.00 20.00 -2.00 314.59 0.00e+00 1.741 0.000 302.00 328.00 3 1.3938e+00 3.7980e-04 1.9722e-02 -6.0000e+00 1.2358e-02 -3.9685e-03 4.2222e-04 1.0112e-02 -6.0000e+00 1.3392e-02 1.1736e-03 2.4246e-04 4.9279e-03 -6.0000e+00 7.9851e-03 -2.6784e-03 1.1003e-04 1.4109e-03 -6.0000e+00 3.4527e-03 1.9114e-02 1.4990e-04 7.6942e-06 1.5989e-05 -6.0000e+00 2.1987e-04 6.1500e-03 0.0000e+00 12 9 1 12 1 1 99.94 25.46 0.32 0.00615 0.00728 485 114 1 5 0 53.160 33.75 20.00 25.46 32.35 0.0 1009.41 -271 -312 -193 -2152 -3257 -2513 -849 299 627 -173 -1788 -1658 -806 -323 650 434 222 534 976 1436 1181 682 1270 1156 623 714 674 -69 -633 209 1271 988 1944 75 -2237 -2611 -2097 -1193 -419 -21 -487 -804 -467 -707 -153 -330 -381 -458 -839 -528 533 598 810 1062 800 887 673 473 347 190 551 1183 1300 1828 802 -226 -572 -966 -54 423 486 512 255 567 206 -244 -711 -1605 -1086 -1040 -1195 -1090 -1804 -1723 -1044 -557 24 125 685 687 496 372 -41 -221 12 66 152 903 633 92 -127 -595 -906 -599 -432 -773 -679 -535 -177 266 595 594 558 270 -11 -227 -70 -168 149 315 82 37 443 372 529 366 77 307 394 242 215 -159 -113 -305 -80 117 -116 210 277 -140 -157 -482 -669 -78 -99 -63 -667 -938 -681 -240 86 202 -60 -609 -560 -282 -120 270 190 100 246 463 665 561 319 597 578 326 368 352 -36 -300 100 604 497 996 41 -1152 -1344 -1122 -688 -263 -15 -368 -606 -363 -557 -119 -257 -291 -351 -629 -387 405 469 639 883 665 744 579 408 292 158 469 1033 1189 1730 776 -208 -517 -838 -47 396 491 525 265 570 202 -231 -625 -1369 -929 -965 -1164 -1102 -1920 -1893 -1184 -661 29 153 849 829 585 412 -44 -229 12 73 175 1114 805 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