File name: Pandora75s1_EssexMD_20260208_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20260209T052734.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20260208_L1_smca1c3d20230525p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20260208 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 session 2 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0305 305.1717 305.3128 305.4540 305.5951 305.7363 305.8774 306.0185 306.1596 306.3007 306.4418 306.5828 306.7239 306.8649 307.0060 307.1470 307.2880 307.4290 307.5700 307.7110 307.8519 307.9929 308.1338 308.2747 308.4157 308.5566 308.6975 308.8384 308.9792 309.1201 309.2610 309.4018 309.5426 309.6834 309.8243 309.9651 310.1058 310.2466 310.3874 310.5281 310.6689 310.8096 310.9503 311.0910 311.2317 311.3724 311.5131 311.6537 311.7944 311.9350 312.0757 312.2163 312.3569 312.4975 312.6381 312.7786 312.9192 313.0598 313.2003 313.3408 313.4813 313.6218 313.7623 313.9028 314.0433 314.1838 314.3242 314.4646 314.6051 314.7455 314.8859 315.0263 315.1667 315.3070 315.4474 315.5877 315.7281 315.8684 316.0087 316.1490 316.2893 316.4296 316.5699 316.7101 316.8504 316.9906 317.1308 317.2710 317.4112 317.5514 317.6916 317.8318 317.9719 318.1121 318.2522 318.3923 318.5324 318.6725 318.8126 318.9527 319.0927 319.2328 319.3728 319.5129 319.6529 319.7929 319.9329 320.0729 320.2128 320.3528 320.4927 320.6327 320.7726 320.9125 321.0524 321.1923 321.3322 321.4721 321.6119 321.7518 321.8916 322.0314 322.1712 322.3110 322.4508 322.5906 322.7304 322.8701 323.0099 323.1496 323.2893 323.4290 323.5687 323.7084 323.8481 323.9877 324.1274 324.2670 324.4067 324.5463 324.6859 324.8255 324.9650 --------------------------------------------------------------------------------------- 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 20260208T123914.4Z 9535.527250 261 1 50.95 2 84.81 114.07 68.46 218.19 0.00 1 0.00 1 0 25 7.042e-01 5.848e-02 3.619e-01 2.629e-02 1.172678e+00 1.602183e-02 1.410066e-02 -6.000000e+00 4.309435e-01 224.74 -2.00 3.48 -2.00 322.26 0.00e+00 -4.310331e-02 5.687670e-03 1.163783e-02 -6.000000e+00 2.083444e-02 276.55 -2.00 20.00 -2.00 321.73 0.00e+00 9.568 0.015 302.00 328.00 3 4.9059e-01 5.5638e-02 1.6057e-01 -6.0000e+00 1.0698e+00 2.3646e+00 6.5063e-02 1.7687e-01 -6.0000e+00 1.1781e+00 -2.8073e+00 3.2113e-02 3.4892e-02 -6.0000e+00 6.8772e-01 1.0190e+00 1.9208e-02 3.7532e-02 -6.0000e+00 2.8373e-01 6.9308e-06 2.9993e-03 6.8294e-04 3.2120e-04 -6.0000e+00 2.3977e-02 2.2828e-02 -8.3626e-05 12 9 8 11 8 0 15.81 22.60 2.48 0.02283 0.04537 22 4 1 5 0 2315.760 25.58 19.98 22.60 -3.78 7.4 808.84 -20340 95697 900000 900000 25668 42448 900000 52642 9235 55705 88122 900000 900000 900000 176678 -7618 28265 38755 84215 56899 900000 29250 78464 54119 23956 99848 47102 -72391 42406 900000 131550 107769 900000 -27158 900000 900000 900000 -51607 900000 900000 139923 900000 900000 144334 -13633 196620 93903 12072 -16562 900000 4011 80521 209644 900000 72168 900000 68766 -2331 3155 15045 101621 306678 5 37756 102108 10465 69100 35454 110412 56550 -39645 330638 -20466 -21028 -11382 900000 46200 169764 19626 -30313 -1172 -7891 -590 84600 -20695 10321 22229 18118 -6526 6672 9499 26881 15725 -17169 -7655 6340 626 -5623 20347 2702 312 -10834 -7972 469 -4717 -17648 -2080 -1867 3628 -351 24892 520 5446 -2406 1643 12805 1868 -2699 -3718 -1758 5288 -4932 2314 -4206 -601 -12269 6057 12319 -1580 4322 -2126 -2211 -1339 -2488 740 -1246 -793 2048 -2001 4368 1518 180 -1197 -5929 7533 900000 900000 2075 2800 900000 4256 1316 5333 6187 900000 900000 900000 4921 -1291 3149 3598 4496 3566 900000 2105 3824 4020 2724 5330 3717 -14954 2264 900000 3359 3002 900000 -2836 900000 900000 900000 -7905 900000 900000 4871 900000 900000 3685 -1456 5020 2833 813 -1538 900000 363 3738 5352 900000 4690 900000 4948 -319 395 1460 3892 7830 1 3374 4953 1282 4940 3892 6484 6353 -12349 8442 -4912 -4510 -1918 900000 3774 4334 2606 -7894 -269 -2236 -172 11232 -8295 3136 6073 5088 -2249 1891 2474 5834 4055 -7013 -3362 2865 350 -3790 11221 1745 190 -6611 -4376 238 -2662 -12030 -1317 -1325 2844 -338 21417 625 6508 -3126 2022 14025 2337 -3673 -5250 -2401 6400 -6246 2623 -4950 -667 -15161 6495 14153 -2481 7493 -4468 -5154 -3392 -6311 1946 -3465 -2222 5532 -5398 11242 3673 412 -2772 SS 20260208T125146.6Z 9535.535956 264 1 51.34 2 82.61 116.16 69.99 220.81 0.00 1 0.00 1 0 17 4.407e-01 2.134e-02 1.868e-01 4.745e-03 1.011608e+00 2.709331e-03 1.097584e-02 -6.000000e+00 2.618857e-01 224.74 -2.00 3.48 -2.00 322.23 0.00e+00 1.341954e-02 1.623962e-03 1.732351e-03 -6.000000e+00 1.160406e-02 276.55 -2.00 20.00 -2.00 321.80 0.00e+00 7.201 0.007 302.00 328.00 3 5.8441e-01 1.0371e-02 9.1276e-02 -6.0000e+00 6.4657e-01 1.1389e+00 1.4074e-02 6.2648e-02 -6.0000e+00 7.0488e-01 -1.5633e+00 1.3217e-02 2.8620e-02 -6.0000e+00 4.1833e-01 6.2423e-01 6.0548e-03 1.6360e-02 -6.0000e+00 1.7342e-01 7.8014e-05 -9.1643e-04 1.2522e-04 2.8834e-04 -6.0000e+00 1.3758e-02 2.1039e-02 -6.7890e-05 12 8 8 10 0 0 -20.51 22.60 0.92 0.02104 0.01415 96 16 1 5 0 534.750 25.58 20.00 22.60 -2.89 7.4 815.66 -181810 -124849 900000 18930 -149016 -112127 900000 -115374 -157184 -116722 -111854 -13629 50509 -24213 -34504 -64001 -4246 44883 3781 -51847 93604 840 4479 11272 -38971 -28240 -64119 -51601 -25019 17911 9309 -10209 28364 3763 26908 77886 4435 -30639 68327 19675 38457 79143 96768 68425 38378 67269 58446 32165 60584 80761 26076 39652 38618 69091 43733 66455 25655 27975 1850 17828 22650 8751 30922 25375 35365 17944 26783 16362 20994 22384 18009 25619 6908 1646 3038 7030 1394 6129 -2883 659 -2268 44 2232 2347 -833 3154 2921 5368 1467 -708 968 -4637 -3041 -5233 -4909 -1399 -2456 -474 -587 -976 -2635 -3939 -3221 -3620 -4311 -4082 -2046 -2836 -546 -272 1165 -178 -653 -2056 -1577 -1236 -782 -267 554 1103 2169 1763 2914 1879 1442 -135 1150 982 1238 750 429 165 -185 -217 10 34 823 685 -283 669 -618 -794 -2627 -8334 -3623 900000 119 -4324 -1980 900000 -1892 -3834 -1865 -1740 -92 234 -316 -638 -1911 -79 547 72 -1679 669 14 70 161 -901 -570 -1780 -1215 -463 249 176 -288 620 109 647 1081 133 -1460 1391 737 1299 1867 1970 1868 1420 1898 1866 1414 2158 2578 1604 2366 2537 3580 3035 3720 2136 2187 178 1419 1771 874 2861 2829 3845 2382 3370 2445 3331 3935 3557 4764 1483 340 549 1099 224 1021 -623 168 -711 16 853 955 -370 1412 1357 2466 691 -326 413 -2018 -1331 -2588 -2854 -862 -1830 -401 -542 -907 -2327 -3154 -2329 -2591 -3256 -3262 -1727 -2680 -579 -335 1613 -249 -949 -3015 -2251 -1741 -1124 -400 856 1705 3197 2698 4224 2662 1994 -186 1596 1514 2046 1448 867 367 -446 -564 27 90 2212 1847 -749 1774 -1529 -1833 -6050 SS 20260208T130231.2Z 9535.543416 267 1 51.56 2 80.76 118.00 71.37 222.99 0.00 1 0.00 1 0 17 6.666e-01 1.750e-02 6.031e-02 1.949e-03 8.815257e-01 1.080503e-03 1.037532e-02 -6.000000e+00 3.933236e-01 224.74 -2.00 3.48 -2.00 321.60 0.00e+00 9.830290e-03 5.599940e-04 5.775028e-03 -6.000000e+00 1.724616e-02 276.55 -2.00 20.00 -2.00 321.13 0.00e+00 5.921 0.004 302.00 328.00 3 5.9915e-01 3.6788e-03 7.6951e-02 -6.0000e+00 9.7107e-01 4.8222e-01 5.2481e-03 5.0905e-02 -6.0000e+00 1.0581e+00 -7.2094e-01 5.4472e-03 3.2579e-02 -6.0000e+00 6.3001e-01 2.9515e-01 2.5259e-03 1.4609e-02 -6.0000e+00 2.6128e-01 3.2205e-04 -5.9757e-04 5.1925e-05 2.7213e-04 -6.0000e+00 2.0619e-02 2.0682e-02 -4.6749e-05 12 8 8 10 0 0 29.13 22.61 0.64 0.02068 0.01619 208 34 1 5 0 247.850 25.58 19.99 22.61 -2.00 7.4 821.87 -280578 -213353 -146700 -185147 -215627 -215623 -161621 -230026 -197602 -221657 -179524 -162530 -117481 -139725 -95984 -81470 -75399 -48013 -74554 -63279 -34811 -44364 -45330 -64729 -70908 -56876 -64940 -66699 -39416 -22378 -15344 -21652 20679 -22595 -29 -16680 -3263 -11582 15371 15934 5551 21731 19330 16844 6672 23030 12425 14927 17736 24122 19012 22397 25836 26494 20107 19841 9078 11239 7741 6584 8754 11735 11980 14017 12272 11403 8598 7778 7563 9202 7456 8028 5039 838 1469 -1994 -2763 -3310 -2553 -1636 -636 -1257 -983 -424 -711 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