File name: Pandora57s1_BoulderCO_20231019_L2Fit_fout2c6d20220707p1-8.txt File generation date: 20231022T201755.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Glen McConville Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 57 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora57_OF_v2d20200724.txt Instrument calibration file used: Pandora57s1_CF_v6d20220707.txt Level 1 file used: Pandora57s1_BoulderCO_20231019_L1_smca1c6d20220707p1-8.txt Full location name: Boulder, CO Short location name: BoulderCO Country of location: USA Location latitude [deg]: 39.9900 Location longitude [deg]: -105.2600 Location altitude [m]: 1660 Local noon date: 20231019 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: Field cal Modification of session 5 "Based on Session 2 "2nd validity period", with updated field cal according to correction campaign Jan 2022" First and last pixel inside fitting window: 262 404 Nominal wavelengths inside fitting window [nm]: 305.1062 305.2469 305.3876 305.5283 305.6689 305.8096 305.9503 306.0909 306.2315 306.3722 306.5128 306.6534 306.7939 306.9345 307.0751 307.2156 307.3562 307.4967 307.6372 307.7777 307.9182 308.0587 308.1992 308.3396 308.4801 308.6205 308.7609 308.9013 309.0417 309.1821 309.3225 309.4629 309.6032 309.7436 309.8839 310.0242 310.1645 310.3048 310.4451 310.5854 310.7257 310.8659 311.0062 311.1464 311.2866 311.4268 311.5670 311.7072 311.8474 311.9875 312.1277 312.2678 312.4079 312.5480 312.6881 312.8282 312.9683 313.1084 313.2484 313.3885 313.5285 313.6685 313.8085 313.9485 314.0885 314.2285 314.3685 314.5084 314.6484 314.7883 314.9282 315.0681 315.2080 315.3479 315.4878 315.6276 315.7675 315.9073 316.0471 316.1869 316.3267 316.4665 316.6063 316.7461 316.8858 317.0256 317.1653 317.3050 317.4447 317.5844 317.7241 317.8638 318.0035 318.1431 318.2828 318.4224 318.5620 318.7016 318.8412 318.9808 319.1203 319.2599 319.3995 319.5390 319.6785 319.8180 319.9575 320.0970 320.2365 320.3760 320.5154 320.6548 320.7943 320.9337 321.0731 321.2125 321.3519 321.4913 321.6306 321.7700 321.9093 322.0486 322.1879 322.3272 322.4665 322.6058 322.7451 322.8843 323.0236 323.1628 323.3020 323.4412 323.5804 323.7196 323.8588 323.9980 324.1371 324.2762 324.4154 324.5545 324.6936 324.8327 324.9718 --------------------------------------------------------------------------------------- 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 20231019T134733.9Z 8692.574698 48 1 49.95 2 84.94 107.59 140.20 87.30 0.00 1 0.00 1 0 25 7.007e-01 2.147e-02 3.711e-01 9.868e-03 9.026542e-01 5.874384e-03 8.987112e-03 -6.000000e+00 4.047283e-01 224.84 -2.00 3.45 -2.00 322.42 0.00e+00 -5.152536e-03 2.796580e-03 1.404651e-03 -6.000000e+00 1.909759e-02 275.09 -2.00 20.00 -2.00 322.04 0.00e+00 9.783 0.016 302.00 328.00 3 3.0735e-01 1.9849e-02 9.3310e-02 -6.0000e+00 1.0093e+00 6.4550e-01 3.1777e-02 4.7862e-02 -6.0000e+00 1.1074e+00 -8.7111e-01 3.7822e-02 2.7623e-02 -6.0000e+00 6.4810e-01 3.4044e-01 1.7638e-02 9.7897e-03 -6.0000e+00 2.7094e-01 6.0861e-05 -6.5097e-04 3.0272e-04 1.3729e-04 -6.0000e+00 2.0465e-02 1.1709e-02 -1.0563e-04 12 9 8 11 8 0 -6.25 19.58 0.38 0.01171 0.00682 129 25 1 5 0 387.200 25.58 20.00 19.58 17.97 23.9 827.26 -218390 900000 -240412 900000 -237471 -136833 900000 -152589 900000 -254892 900000 -119400 900000 900000 -161225 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-920 2300 -441 2754 1195 2849 2448 1689 2976 -885 1706 1455 1355 2502 911 3384 -1141 2968 1046 2485 3632 1714 8352 25 2678 -959 1329 1650 -952 1448 -624 1970 159 -87 2457 -1632 2211 -928 1359 -642 -576 2534 -1099 -109 -2015 -49 624 128 1501 -2545 -794 -3259 -865 -2031 -2338 -662 -3776 522 -3419 -670 -2519 -341 403 -632 1420 -3049 785 -687 -1047 -546 -1745 3269 2013 2034 1712 806 3178 398 3342 -946 2379 1907 442 1174 -3379 2889 -1710 1817 -957 34 1570 -1077 -176 -4290 SS 20231019T135743.3Z 8692.581751 51 1 50.04 2 83.09 109.29 138.36 88.95 0.00 1 0.00 1 0 17 5.252e-01 6.915e-03 2.310e-01 2.767e-03 7.521023e-01 1.505978e-03 7.764732e-03 -6.000000e+00 3.001124e-01 224.83 -2.00 3.45 -2.00 321.79 0.00e+00 3.046796e-03 6.583629e-04 9.091767e-04 -6.000000e+00 1.306578e-02 275.09 -2.00 20.00 -2.00 321.43 0.00e+00 7.639 0.008 302.00 328.00 3 2.5850e-01 4.7538e-03 7.3485e-02 -6.0000e+00 7.4552e-01 8.2567e-02 7.7599e-03 3.9805e-02 -6.0000e+00 8.1657e-01 -8.1417e-02 9.8354e-03 2.2958e-02 -6.0000e+00 4.7947e-01 2.3027e-02 4.6613e-03 7.9017e-03 -6.0000e+00 2.0069e-01 3.9772e-04 -7.2537e-04 8.1810e-05 9.5004e-05 -6.0000e+00 1.4936e-02 1.1250e-02 -1.1126e-04 11 9 0 11 8 0 11.54 19.58 0.32 0.01125 0.00580 368 73 1 5 0 135.960 25.47 20.00 19.58 19.33 23.9 835.38 900000 -96824 -200712 -25500 -269705 900000 -246977 41372 -181280 -156898 900000 -195903 900000 -138079 -46499 -42153 -80007 132226 -97144 2950 -73273 -20740 -45295 -51552 -7071 -72106 33191 -55216 -2546 -22880 -40588 -3137 -38793 6349 -25804 11314 -12670 -16169 -3646 -15843 6957 -4488 4129 2701 -3515 7656 -11134 16800 1103 13679 -1422 371 5055 -1133 5518 679 3255 -825 -2733 4618 -1251 7582 1724 5696 1885 836 2365 29 5126 469 3765 2425 658 2632 -877 3304 -2137 -852 -120 -1654 1360 -2257 -249 -1739 -259 -515 -720 1389 -186 741 38 701 -309 -556 731 -279 1199 274 471 -79 -1216 -498 -503 -59 -1329 -716 -1218 -1037 71 -225 567 -141 218 -99 -672 329 -484 571 -57 -130 204 157 582 -70 1022 -94 595 561 17 340 -266 196 -485 75 -65 -261 459 -123 224 30 89 -267 -449 900000 -261 -886 -69 -2182 900000 -1877 112 -1027 -762 900000 -1955 900000 -1378 -238 -250 -798 357 -1415 17 -909 -157 -476 -639 -61 -1264 206 -819 -23 -302 -799 -52 -1057 115 -626 198 -325 -523 -129 -752 295 -230 205 140 -199 403 -739 897 74 904 -125 36 519 -123 658 81 426 -111 -365 573 -175 1100 279 996 356 159 453 6 1164 128 1078 722 193 706 -220 723 -480 -202 -33 -556 521 -1023 -120 -910 -143 -303 -442 852 -115 430 21 362 -160 -313 468 -212 1047 276 504 -83 -1201 -438 -411 -49 -1202 -678 -1237 -1143 86 -311 793 -209 322 -155 -1006 475 -720 884 -85 -199 331 244 872 -102 1417 -128 795 812 28 587 -509 400 -1056 173 -162 -676 1204 -329 587 75 207 -590 -978 SS 20231019T140800.3Z 8692.588893 54 1 50.09 2 81.24 111.04 136.50 90.56 0.00 1 0.00 1 0 25 2.713e-01 4.184e-03 7.763e-02 1.231e-03 6.390306e-01 6.521281e-04 6.873824e-03 -6.000000e+00 1.539711e-01 224.83 -2.00 3.45 -2.00 321.21 0.00e+00 1.780659e-03 2.529852e-04 6.026876e-04 -6.000000e+00 6.297529e-03 275.09 -2.00 20.00 -2.00 320.85 0.00e+00 6.222 0.004 302.00 328.00 3 1.9974e-01 1.9418e-03 6.0373e-02 -6.0000e+00 3.8270e-01 3.3290e-02 2.7040e-03 3.3124e-02 -6.0000e+00 4.1877e-01 -1.0449e-02 3.2158e-03 1.8202e-02 -6.0000e+00 2.4674e-01 -5.8330e-03 1.6033e-03 5.9673e-03 -6.0000e+00 1.0245e-01 1.3989e-03 -5.8770e-04 3.6662e-05 7.4360e-05 -6.0000e+00 7.6031e-03 1.0692e-02 -1.0852e-04 10 0 0 10 0 0 -3.09 19.59 0.24 0.01069 0.00628 720 142 1 5 0 69.570 25.58 20.00 19.59 20.90 24.0 844.90 -85097 -83401 -103092 -65100 -125138 -101935 -103084 -55019 -91502 -81719 -61861 -73869 -27153 -45510 -31273 -17863 -24022 -10779 -16454 -2862 -12764 -15997 -10774 -12730 -4175 -19897 -2835 -16045 -10636 -9359 -11767 1744 -8487 -948 -3144 -5639 -1936 -4293 1388 -1718 1655 -2247 123 -566 -1245 324 -1681 768 -900 312 1881 1170 2220 21 818 520 -58 -177 -908 1041 308 2806 2780 2299 1297 873 520 51 1585 927 967 407 431 601 -623 -264 -1146 -517 -452 -453 -307 -1814 -1578 -1424 -899 -414 15 681 419 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