File name: Pandora253s1_TucsonAZ_20250919_L2Fit_fout2c3d20231207p1-8.txt File generation date: 20250920T072841.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Armin Sorooshian Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 253 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora253_OF_v3d20221208.txt Instrument calibration file used: Pandora253s1_CF_v3d20231207.txt Level 1 file used: Pandora253s1_TucsonAZ_20250919_L1_smca1c3d20231207p1-8.txt Full location name: University of Arizona Department of Chemical and Environmental Engineering Short location name: TucsonAZ Country of location: United States Location latitude [deg]: 32.2330 Location longitude [deg]: -110.9530 Location altitude [m]: 779 Local noon date: 20250919 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Modification of session 2 "Clearance session based on OOB session1, absolute calibration done with an uncalibrated lamp, certificate of FEL1441 (GSFC) used"" First and last pixel inside fitting window: 192 334 Nominal wavelengths inside fitting window [nm]: 305.0168 305.1576 305.2984 305.4391 305.5798 305.7205 305.8612 306.0019 306.1426 306.2833 306.4240 306.5646 306.7052 306.8459 306.9865 307.1271 307.2677 307.4083 307.5488 307.6894 307.8299 307.9705 308.1110 308.2515 308.3920 308.5325 308.6729 308.8134 308.9539 309.0943 309.2347 309.3751 309.5156 309.6559 309.7963 309.9367 310.0771 310.2174 310.3577 310.4981 310.6384 310.7787 310.9190 311.0593 311.1995 311.3398 311.4800 311.6203 311.7605 311.9007 312.0409 312.1811 312.3212 312.4614 312.6016 312.7417 312.8818 313.0219 313.1620 313.3021 313.4422 313.5823 313.7223 313.8624 314.0024 314.1424 314.2825 314.4225 314.5624 314.7024 314.8424 314.9823 315.1223 315.2622 315.4021 315.5420 315.6819 315.8218 315.9617 316.1016 316.2414 316.3812 316.5211 316.6609 316.8007 316.9405 317.0802 317.2200 317.3598 317.4995 317.6392 317.7790 317.9187 318.0584 318.1981 318.3377 318.4774 318.6170 318.7567 318.8963 319.0359 319.1755 319.3151 319.4547 319.5943 319.7338 319.8734 320.0129 320.1524 320.2919 320.4314 320.5709 320.7104 320.8498 320.9893 321.1287 321.2681 321.4076 321.5470 321.6864 321.8257 321.9651 322.1045 322.2438 322.3831 322.5225 322.6618 322.8011 322.9404 323.0796 323.2189 323.3581 323.4974 323.6366 323.7758 323.9150 324.0542 324.1934 324.3326 324.4717 324.6109 324.7500 324.8891 --------------------------------------------------------------------------------------- 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 20250919T140801.7Z 9393.588909 115 1 54.69 2 78.67 95.76 53.58 98.83 0.00 1 0.00 1 0 25 2.548e-01 7.688e-03 2.392e-01 4.157e-03 5.895742e-01 2.297117e-03 6.429972e-03 -6.000000e+00 1.495010e-01 228.18 -2.00 3.29 -2.00 320.96 0.00e+00 2.768483e-03 1.040767e-03 4.759508e-04 -6.000000e+00 7.055601e-03 288.02 -2.00 20.00 -2.00 320.33 0.00e+00 4.919 0.002 302.00 328.00 3 2.6244e+00 7.6528e-03 5.3604e-02 -6.0000e+00 3.7094e-01 1.1269e-01 1.0279e-02 3.0037e-02 -6.0000e+00 4.0109e-01 -6.8697e-02 9.9837e-03 1.6086e-02 -6.0000e+00 2.3873e-01 8.7133e-03 4.8522e-03 6.3024e-03 -6.0000e+00 1.0426e-01 2.1869e-04 8.4211e-05 1.2397e-04 6.9039e-05 -6.0000e+00 7.1609e-03 -2.4016e-02 0.0000e+00 11 8 0 10 0 0 99.97 26.00 0.54 -0.02402 -0.02338 173 16 1 5 0 316.090 33.00 20.00 26.00 31.07 4.2 990.34 900000 900000 -64084 152395 -89742 139562 900000 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411 638 533 -70 560 531 331 967 -212 -315 -442 -96 -366 389 -566 647 -1175 -567 -1321 -995 -198 -1156 -667 388 470 -568 -610 468 144 1107 1542 619 126 603 453 -154 -705 -442 1106 1016 -152 -2191 -2100 -607 171 513 -53 -987 -728 756 656 1644 1682 1015 1238 -796 -2367 61 -666 -246 592 -568 448 2185 1599 1006 -115 -627 -599 508 114 -903 -1245 -135 -537 -1249 598 219 1417 SS 20250919T143302.0Z 9393.606273 127 1 51.57 2 73.43 99.28 48.54 102.98 0.00 1 0.00 1 0 25 1.244e-01 8.938e-03 1.211e-01 6.283e-03 4.195111e-01 3.320495e-03 4.686211e-03 -6.000000e+00 7.247343e-02 228.18 -2.00 3.29 -2.00 319.84 0.00e+00 7.989910e-04 1.024154e-03 1.672168e-04 -6.000000e+00 3.244039e-03 288.02 -2.00 20.00 -2.00 319.11 0.00e+00 3.452 0.001 302.00 328.00 3 4.6248e+00 9.6518e-03 3.7671e-02 -6.0000e+00 1.7994e-01 9.4072e-02 1.1632e-02 2.0862e-02 -6.0000e+00 1.9441e-01 -3.2114e-02 9.3271e-03 1.0402e-02 -6.0000e+00 1.1609e-01 3.3813e-03 4.8275e-03 3.2093e-03 -6.0000e+00 5.0374e-02 1.2917e-04 2.0652e-04 1.9116e-04 3.6493e-05 -6.0000e+00 3.4530e-03 -2.4747e-02 0.0000e+00 12 9 1 12 1 1 99.99 26.01 0.67 -0.02475 -0.02319 43 4 1 5 0 1171.950 33.25 20.00 26.01 32.00 4.0 994.84 900000 -39746 -7793 35519 -2134 3775 -21455 67068 -21707 43165 -44226 70161 13166 43341 -11627 14315 -5918 18411 -9448 -975 -5721 3271 15616 1789 -905 -7511 -7080 -7510 -7918 -5620 1053 -1962 3098 -7885 2019 6382 1588 -5087 -3229 4348 -5076 -2214 1145 -2472 2386 3479 3089 -1332 343 -5191 -1709 3455 2685 922 2551 -105 -1349 -384 865 1987 2369 -282 968 1308 916 283 -882 450 4459 187 -713 -1001 991 -757 -144 -719 1206 617 -613 1100 715 -410 -1884 -809 -293 -455 -347 -403 109 -536 -211 -85 1844 1824 2143 -176 1469 225 -522 -511 -968 -551 583 1842 -906 -2298 -1183 -680 331 107 -178 -398 -56 84 -77 1406 1186 852 1038 -321 -1176 -838 -682 -169 1068 483 377 1650 1441 291 187 -542 799 876 -530 -458 -341 -81 -429 -229 -386 -95 806 900000 -1040 -161 475 -38 59 -442 635 -568 649 -1650 860 323 941 -524 582 -326 851 -616 -61 -392 206 878 123 -69 -644 -623 -648 -648 -441 83 -179 302 -935 215 618 168 -657 -493 741 -1088 -498 261 -600 555 806 721 -323 82 -1336 -448 939 797 298 859 -37 -503 -143 314 768 919 -119 442 656 489 149 -441 215 2120 104 -450 -678 671 -508 -90 -412 610 295 -302 595 447 -293 -1506 -680 -260 -432 -350 -424 116 -564 -209 -78 1524 1439 1742 -162 1501 262 -676 -683 -1252 -655 626 1893 -1010 -2789 -1490 -897 458 159 -290 -685 -97 139 -120 2003 1637 1204 1545 -516 -1973 -1393 -1100 -263 1565 680 507 2141 1972 442 307 -949 1428 1624 -1051 -964 -744 -181 -971 -510 -828 -193 1563 SS 20250919T144324.2Z 9393.613475 130 1 29.41 2 71.27 100.78 46.48 104.85 0.00 1 0.00 1 0 25 3.626e-02 7.783e-03 3.496e-02 3.982e-03 3.760853e-01 2.060695e-03 4.230089e-03 -6.000000e+00 2.112174e-02 228.18 -2.00 3.29 -2.00 319.05 0.00e+00 1.140560e-03 4.923555e-04 1.243334e-04 -6.000000e+00 9.454633e-04 288.02 -2.00 20.00 -2.00 318.26 0.00e+00 3.077 0.000 302.00 328.00 3 4.4198e+00 5.7106e-03 3.3616e-02 -6.0000e+00 5.2443e-02 7.8574e-02 6.6262e-03 1.8639e-02 -6.0000e+00 5.6659e-02 -1.4455e-02 4.7725e-03 9.1607e-03 -6.0000e+00 3.3834e-02 -6.4396e-03 2.5213e-03 2.9136e-03 -6.0000e+00 1.4681e-02 2.3462e-04 2.9065e-04 1.1857e-04 3.2390e-05 -6.0000e+00 1.0064e-03 -2.4429e-02 0.0000e+00 12 9 1 12 9 1 98.71 26.01 0.26 -0.02443 -0.02224 10 2 1 5 0 2672.740 33.25 20.01 26.01 32.48 4.1 998.47 900000 1061 -11542 -15926 -16018 -16062 -4221 -9162 -6984 -1870 -13882 2216 2904 -6398 -8483 -6743 822 4542 -1731 -153 2678 -3214 -4160 2580 2763 5838 -1693 -6301 -2567 -2069 7328 -1637 1810 3347 -5109 1464 -817 -1984 -771 -170 -2164 -2284 -1390 817 1628 -854 -6 854 602 748 814 1375 439 1148 589 1734 669 -1212 686 -892 998 899 839 1287 1859 -839 -147 799 1921 309 9 -835 -523 432 -740 -439 581 322 1507 824 -1152 -991 -983 -970 -1053 -769 -588 -297 -228 -74 -6 1127 -73 2328 2189 429 406 643 78 -1349 -568 -581 181 1167 -66 -1667 -810 -833 -100 120 -259 -511 -608 20 525 989 1543 1293 308 -203 -1193 -244 -379 178 274 192 519 2186 841 468 235 -652 301 7 242 -291 -240 210 -377 -589 120 -528 481 900000 33 -444 -637 -585 -543 -129 -327 -277 -77 -663 92 134 -385 -619 -560 70 393 -169 -15 272 -348 -459 280 321 694 -223 -847 -313 -245 837 -228 271 535 -877 223 -133 -371 -171 -45 -665 -756 -477 281 560 -302 -2 295 207 260 296 541 188 520 283 849 340 -633 346 -448 497 473 485 811 1226 -553 -90 467 1140 208 6 -621 -395 316 -567 -305 360 187 873 533 -871 -843 -834 -872 -1003 -784 -635 -334 -260 -83 -6 1085 -66 2125 2055 409 436 773 103 -1873 -752 -712 202 1253 -76 -2090 -1057 -1143 -144 185 -395 -821 -980 34 813 1419 2127 1824 463 -328 -2019 -408 -618 279 411 274 705 2846 1162 707 385 -1133 534 13 429 -551 -472 420 -769 -1192 232 -984 853 SS 20250919T144756.5Z 9393.616626 134 1 3.65 2 70.33 101.45 45.58 105.70 0.00 1 0.00 1 0 25 1.863e-02 8.475e-03 3.822e-03 1.147e-03 3.600528e-01 5.930181e-04 4.051322e-03 -6.000000e+00 1.085588e-02 228.18 -2.00 3.29 -2.00 317.31 0.00e+00 4.773323e-04 8.679342e-05 1.111748e-04 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