File name: Pandora253s1_TucsonAZ_20240416_L2Fit_fout2c1d20230118p1-8.txt File generation date: 20240417T072806.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Manish Naja Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 253 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora253_OF_v2d20221208.txt Instrument calibration file used: Pandora253s1_CF_v1d20230118.txt Level 1 file used: Pandora253s1_TucsonAZ_20240416_L1_smca1c1d20230118p1-8.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: 20240416 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: Full lab calibration+OOB session, 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]: 305.0464 305.1873 305.3281 305.4689 305.6097 305.7505 305.8913 306.0321 306.1728 306.3136 306.4543 306.5950 306.7358 306.8765 307.0171 307.1578 307.2985 307.4391 307.5798 307.7204 307.8610 308.0016 308.1422 308.2828 308.4234 308.5639 308.7045 308.8450 308.9856 309.1261 309.2666 309.4071 309.5475 309.6880 309.8285 309.9689 310.1093 310.2498 310.3902 310.5306 310.6709 310.8113 310.9517 311.0920 311.2323 311.3727 311.5130 311.6533 311.7936 311.9339 312.0741 312.2144 312.3546 312.4948 312.6351 312.7753 312.9155 313.0556 313.1958 313.3360 313.4761 313.6162 313.7564 313.8965 314.0366 314.1767 314.3167 314.4568 314.5969 314.7369 314.8769 315.0169 315.1569 315.2969 315.4369 315.5769 315.7168 315.8568 315.9967 316.1366 316.2765 316.4164 316.5563 316.6962 316.8360 316.9759 317.1157 317.2556 317.3954 317.5352 317.6750 317.8147 317.9545 318.0942 318.2340 318.3737 318.5134 318.6531 318.7928 318.9325 319.0722 319.2118 319.3515 319.4911 319.6307 319.7703 319.9099 320.0495 320.1891 320.3286 320.4682 320.6077 320.7472 320.8868 321.0263 321.1657 321.3052 321.4447 321.5841 321.7236 321.8630 322.0024 322.1418 322.2812 322.4206 322.5600 322.6993 322.8386 322.9780 323.1173 323.2566 323.3959 323.5352 323.6744 323.8137 323.9529 324.0922 324.2314 324.3706 324.5098 324.6490 324.7882 324.9273 --------------------------------------------------------------------------------------- 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 20240416T132304.8Z 8872.557694 113 1 54.94 2 84.56 81.10 123.21 344.43 0.00 1 0.00 1 0 17 5.567e-01 2.135e-02 5.175e-01 1.863e-02 1.118068e+00 1.160080e-02 1.158063e-02 -6.000000e+00 3.239538e-01 228.95 -2.00 3.29 -2.00 322.65 0.00e+00 -8.941528e-03 7.252466e-03 5.446537e-03 -6.000000e+00 1.464215e-02 282.20 -2.00 20.00 -2.00 322.26 0.00e+00 9.229 0.010 302.00 328.00 3 2.2616e-02 5.0338e-02 1.0672e-01 -6.0000e+00 8.0720e-01 1.6066e+00 6.7692e-02 6.8833e-02 -6.0000e+00 8.7311e-01 -1.9886e+00 5.6408e-02 3.6245e-02 -6.0000e+00 5.2008e-01 7.6193e-01 2.6093e-02 1.1092e-02 -6.0000e+00 2.2342e-01 3.4050e-05 -1.7940e-03 5.0172e-04 2.1374e-04 -6.0000e+00 1.5555e-02 -2.9699e-02 0.0000e+00 12 8 8 10 0 0 53.29 25.32 0.90 -0.02970 -0.04318 64 6 1 5 0 858.290 32.75 20.00 25.32 18.31 4.4 925.21 -104899 900000 -25851 -46416 -95601 5472 164799 -59019 -85535 -139318 -87320 188416 900000 83609 -9160 -10679 31145 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2793 1173 1606 425 2559 -415 2825 1832 1513 2388 2609 1627 2616 4062 2277 5112 3837 3585 731 1779 1234 -3593 2214 719 2405 -1453 2514 -61 1680 5144 -1007 1569 -2317 -2335 2718 -3075 -1657 -1104 -1093 -1444 449 -2787 1566 -4032 -2637 -230 -752 -1362 -714 -882 784 -488 -2629 -2906 -1200 -774 520 -3876 2960 -1058 498 2297 -368 1058 2175 196 1305 1921 2019 -2525 3325 2322 1921 -2575 1631 1036 1300 -119 46 -1016 749 -997 765 -818 -1794 909 -1441 SS 20240416T133503.7Z 8872.566015 116 1 54.74 2 82.05 82.66 123.83 347.50 0.00 1 0.00 1 0 17 7.455e-01 5.940e-03 2.939e-01 2.752e-03 8.993952e-01 1.574494e-03 9.155404e-03 -6.000000e+00 4.336005e-01 228.95 -2.00 3.29 -2.00 321.93 0.00e+00 4.606137e-03 9.226828e-04 1.476451e-03 -6.000000e+00 1.891791e-02 282.20 -2.00 20.00 -2.00 321.47 0.00e+00 6.758 0.004 302.00 328.00 3 8.5671e-02 6.0429e-03 7.8623e-02 -6.0000e+00 1.0805e+00 2.8931e-01 1.0192e-02 5.3714e-02 -6.0000e+00 1.1692e+00 -2.9182e-01 1.1737e-02 2.8759e-02 -6.0000e+00 6.9575e-01 9.6262e-02 5.2271e-03 1.2571e-02 -6.0000e+00 2.9623e-01 3.9652e-04 -5.9477e-04 7.3877e-05 1.3527e-04 -6.0000e+00 2.0548e-02 -3.1351e-02 0.0000e+00 10 0 0 10 0 0 9.37 25.32 0.49 -0.03135 -0.03582 255 24 1 5 0 214.650 32.75 20.00 25.32 18.89 4.4 930.71 -214775 -287389 -252851 -230261 -277069 -195826 -274483 -279732 -54383 -182021 -242877 -105067 -101952 -195999 -102217 -63999 -83301 -109120 -65490 -34747 -40643 -88296 -75464 -62597 -46015 -64004 -75216 -59908 -62509 -34939 -21712 -28829 -1806 -35071 -29957 -38261 -34358 4648 -10020 -14664 15061 9342 9242 -8414 7012 20062 1535 -148 747 14191 -5004 -3562 5561 4167 3542 11137 5555 941 4419 -2798 -773 1010 8177 5004 -1067 4642 1504 -245 2008 2881 2113 2361 2025 2252 -136 -949 -3655 -3023 -1432 -1283 -267 -510 -1304 -1281 -645 464 274 1426 1460 449 630 419 -940 -929 -114 -741 273 895 32 16 -536 -282 -216 -52 -828 -1582 -1763 -617 -311 109 -164 111 -49 -8 -66 187 469 403 126 63 -260 382 366 99 51 18 -17 1072 646 98 -108 54 -162 -54 -31 -352 -187 302 -51 2 138 -68 -143 -576 -1472 -1049 -787 -1420 -526 -1406 -1706 -146 -533 -1422 -282 -274 -1530 -424 -234 -447 -879 -383 -161 -208 -732 -571 -458 -314 -562 -771 -526 -564 -264 -198 -364 -21 -659 -539 -729 -673 72 -223 -421 376 273 290 -330 241 625 60 -6 34 625 -303 -246 396 334 312 962 529 95 418 -275 -75 105 915 677 -172 728 246 -43 380 626 523 620 534 561 -32 -198 -725 -605 -318 -345 -86 -194 -566 -600 -320 242 151 801 823 249 328 206 -455 -466 -64 -497 215 824 33 17 -565 -268 -181 -42 -694 -1422 -1674 -624 -347 138 -219 162 -75 -12 -98 266 663 591 195 101 -415 578 525 137 75 26 -24 1511 943 167 -210 116 -375 -132 -82 -914 -499 812 -138 6 366 -166 -332 SS 20240416T135046.5Z 8872.576927 121 1 54.83 2 78.74 84.69 124.45 351.61 0.00 1 0.00 1 0 17 3.377e-01 5.006e-03 4.595e-02 7.977e-04 6.882002e-01 4.297935e-04 7.241336e-03 -6.000000e+00 1.964577e-01 228.95 -2.00 3.29 -2.00 320.93 0.00e+00 3.115998e-03 1.933824e-04 5.908094e-04 -6.000000e+00 8.570602e-03 282.20 -2.00 20.00 -2.00 320.38 0.00e+00 4.948 0.002 302.00 328.00 3 3.6512e-02 1.4057e-03 5.7037e-02 -6.0000e+00 4.8958e-01 1.0418e-01 1.9218e-03 3.5613e-02 -6.0000e+00 5.2972e-01 -8.3551e-02 1.9962e-03 1.8774e-02 -6.0000e+00 3.1522e-01 2.0219e-02 9.6618e-04 7.8195e-03 -6.0000e+00 1.3423e-01 2.5076e-03 -5.3864e-04 2.2136e-05 7.6635e-05 -6.0000e+00 9.3084e-03 -3.2170e-02 0.0000e+00 10 0 0 10 0 0 43.94 25.28 0.41 -0.03217 -0.03622 660 62 1 5 0 83.070 32.75 19.99 25.28 19.86 4.4 937.84 -106896 -118217 -106491 -128714 -123939 -118984 -100368 -114291 -95747 -94355 -89864 -72652 -73845 -48400 -41409 -30881 -25358 -26891 -18282 -26207 -23051 -17077 -21401 -23343 -16878 -22240 -22470 -20400 -16195 -20251 -12588 -5769 -6712 -6898 -9026 -10928 -5851 -7438 -3303 -2711 -3181 -3038 -802 -1568 1251 241 -1087 -141 -305 1011 1218 783 1661 2255 1855 1424 1242 362 -714 148 1300 1468 2819 2549 2070 1337 933 789 1355 1475 918 635 628 247 -102 -309 -775 -1526 -1100 -821 -921 -650 -1376 -1541 -712 -718 -193 200 761 699 917 955 484 449 400 22 -1 537 200 -205 -360 -558 -126 428 -701 -1344 -964 -836 -439 38 -125 -145 -31 143 -27 412 555 483 374 -221 -509 -56 198 105 163 176 173 1148 739 159 -41 -108 -124 -7 15 -288 -216 262 -32 -193 -40 -13 -18 -393 -602 -542 -837 -719 -694 -515 -765 -611 -661 -643 -486 -626 -418 -432 -360 -327 -397 -274 -457 -407 -287 -388 -470 -349 -521 -549 -484 -362 -498 -338 -177 -246 -284 -380 -456 -248 -374 -196 -195 -266 -278 -76 -157 124 25 -116 -16 -35 124 165 120 280 415 369 299 271 81 -157 31 277 338 726 751 668 437 300 260 479 597 421 311 310 117 -45 -122 -281 -551 -429 -376 -500 -370 -880 -1058 -516 -556 -157 168 640 574 707 685 332 309 302 19 -1 572 238 -254 -426 -603 -133 433 -755 -1553 -1070 -988 -561 54 -200 -231 -50 226 -45 639 847 762 623 -358 -833 -88 323 165 247 256 243 1611 1148 260 -75 -214 -259 -14 32 -667 -516 632 -78 -459 -90 -28 -38 SS 20240416T135627.1Z 8872.580869 124 1 54.84 2 77.54 85.42 124.61 353.11 0.00 1 0.00 1 0 25 2.182e-01 4.732e-03 2.803e-02 5.979e-04 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