File name: Pandora107s1_LynnMA_20240619_L2Fit_fout2c7d20230718p1-8.txt File generation date: 20240916T085634.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c7p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 107 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora107_OF_v1d20230601.txt Instrument calibration file used: Pandora107s1_CF_v7d20230718.txt Level 1 file used: Pandora107s1_LynnMA_20240619_L1_smca1c7d20230718p1-8.txt Full location name: Lynn Massachusetts Department of Environmental Protection Short location name: LynnMA Country of location: United States Location latitude [deg]: 42.4746 Location longitude [deg]: -70.9708 Location altitude [m]: 52 Local noon date: 20240619 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: OOB session based on clearance session 6 First and last pixel inside fitting window: 220 362 Nominal wavelengths inside fitting window [nm]: 305.0382 305.1791 305.3200 305.4608 305.6017 305.7426 305.8834 306.0242 306.1650 306.3059 306.4467 306.5874 306.7282 306.8690 307.0097 307.1505 307.2912 307.4319 307.5727 307.7134 307.8540 307.9947 308.1354 308.2761 308.4167 308.5573 308.6980 308.8386 308.9792 309.1198 309.2604 309.4009 309.5415 309.6820 309.8226 309.9631 310.1036 310.2441 310.3846 310.5251 310.6656 310.8060 310.9465 311.0869 311.2273 311.3678 311.5082 311.6485 311.7889 311.9293 312.0697 312.2100 312.3504 312.4907 312.6310 312.7713 312.9116 313.0519 313.1922 313.3324 313.4727 313.6129 313.7531 313.8934 314.0336 314.1738 314.3139 314.4541 314.5943 314.7344 314.8746 315.0147 315.1548 315.2949 315.4350 315.5751 315.7152 315.8552 315.9953 316.1353 316.2754 316.4154 316.5554 316.6954 316.8354 316.9753 317.1153 317.2552 317.3952 317.5351 317.6750 317.8149 317.9548 318.0947 318.2346 318.3744 318.5143 318.6541 318.7939 318.9338 319.0736 319.2134 319.3531 319.4929 319.6327 319.7724 319.9121 320.0519 320.1916 320.3313 320.4710 320.6107 320.7503 320.8900 321.0296 321.1693 321.3089 321.4485 321.5881 321.7277 321.8673 322.0068 322.1464 322.2859 322.4255 322.5650 322.7045 322.8440 322.9835 323.1230 323.2624 323.4019 323.5413 323.6808 323.8202 323.9596 324.0990 324.2384 324.3777 324.5171 324.6564 324.7958 324.9351 --------------------------------------------------------------------------------------- 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 20240619T104019.6Z 8936.444671 177 1 29.56 2 75.31 71.50 130.36 274.27 0.00 1 0.00 1 0 25 2.264e-01 1.061e-02 1.822e-01 6.231e-03 5.565313e-01 3.391423e-03 6.607881e-03 -6.000000e+00 1.376290e-01 232.95 -2.00 3.54 -2.00 320.57 0.00e+00 4.113829e-03 1.358800e-03 2.170285e-03 -6.000000e+00 6.208494e-03 285.98 -2.00 20.00 -2.00 319.91 0.00e+00 3.863 0.001 302.00 328.00 3 4.0415e+00 1.0690e-02 4.9576e-02 -6.0000e+00 3.4559e-01 6.8869e-02 1.3530e-02 3.1721e-02 -6.0000e+00 3.7241e-01 -1.2715e-01 1.1958e-02 1.7092e-02 -6.0000e+00 2.2138e-01 4.4226e-02 5.9187e-03 5.8109e-03 -6.0000e+00 9.2860e-02 1.0415e-04 -1.0299e-04 1.8893e-04 8.0118e-05 -6.0000e+00 6.7268e-03 -2.9913e-02 0.0000e+00 12 8 8 10 0 0 57.06 22.21 0.67 -0.02991 -0.03069 15 15 1 5 0 1970.500 26.32 20.00 22.21 28.87 0.0 958.24 -102893 -103067 -10715 -67429 900000 16639 -123257 -112262 -2956 -31363 -21126 -47156 -67564 -8120 6993 17632 106 -15167 32855 -1380 8141 -15786 21531 13871 -17367 15146 -34872 -9263 -6526 -37998 968 -13798 4113 1008 -9542 -106 -7749 9633 -1490 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-785 -502 -508 401 390 -1477 248 450 956 3182 2103 1651 1499 -1028 -1382 -841 748 -2 537 88 758 2303 2358 -625 -858 -619 161 561 -563 -490 -829 -92 -1386 -1270 -401 930 1227 SS 20240619T105042.5Z 8936.451881 180 1 17.05 2 73.49 73.09 132.20 276.08 0.00 1 0.00 1 0 25 1.298e-01 1.019e-02 4.346e-02 2.684e-03 5.013165e-01 1.440160e-03 5.922378e-03 -6.000000e+00 7.883797e-02 232.95 -2.00 3.54 -2.00 319.74 0.00e+00 4.165255e-03 4.401783e-04 1.199418e-03 -6.000000e+00 3.496984e-03 285.98 -2.00 20.00 -2.00 319.01 0.00e+00 3.462 0.001 302.00 328.00 3 2.7231e+00 4.1695e-03 4.3978e-02 -6.0000e+00 1.9807e-01 2.8021e-02 4.9732e-03 2.7061e-02 -6.0000e+00 2.1342e-01 -7.1595e-02 3.9895e-03 1.4424e-02 -6.0000e+00 1.2692e-01 1.9458e-02 2.0564e-03 5.5340e-03 -6.0000e+00 5.3213e-02 6.1032e-04 -1.0047e-04 7.9808e-05 6.4022e-05 -6.0000e+00 3.8237e-03 -3.0875e-02 0.0000e+00 12 9 9 12 1 1 81.97 22.22 0.39 -0.03087 -0.03163 30 55 1 5 0 549.550 26.32 20.00 22.22 28.98 0.0 958.74 -54797 -32812 -38689 -41149 -44035 -43035 -46003 -40491 -27127 -37849 -38626 -47528 -13278 -27631 -18754 -9179 -2394 5170 -9936 -65 -338 3856 4929 -1349 -14243 -5757 -7140 -5694 -6084 -6401 513 33 -1411 -2522 -3224 2220 -515 835 -1733 -2305 -2285 -1120 -1741 -976 -361 1861 1442 273 2912 2984 3365 3023 2540 1689 2433 802 605 -1390 -1195 985 2411 3232 2310 1655 39 -30 2764 2548 2797 1124 -53 -805 -830 -1780 -552 -598 -481 328 1136 -634 -1096 -1214 -1932 -992 -535 -672 146 -655 567 -307 59 742 1157 1999 1777 658 105 55 -1343 -2141 -1349 -233 1125 1326 -844 -2362 -1534 -668 567 550 -16 -617 -326 -29 1039 1960 2283 1434 839 -470 -842 -396 132 -107 140 -333 853 2149 621 -572 -739 -607 278 509 -172 -583 -13 413 -546 -706 -337 -6 867 -975 -558 -760 -829 -876 -800 -891 -827 -547 -911 -981 -1431 -330 -984 -756 -396 -109 240 -575 -4 -20 219 280 -85 -1104 -434 -549 -426 -455 -491 40 3 -150 -290 -377 242 -60 111 -288 -412 -461 -243 -402 -230 -86 444 351 68 725 773 929 919 852 613 920 322 250 -590 -500 399 983 1403 1029 818 21 -16 1364 1238 1455 670 -36 -575 -599 -1256 -359 -356 -262 171 620 -400 -805 -933 -1641 -895 -510 -635 146 -686 589 -314 58 715 1034 1745 1658 649 119 65 -1762 -2930 -1756 -273 1288 1505 -1030 -2920 -1987 -902 811 808 -26 -988 -525 -48 1588 2814 3219 2104 1312 -785 -1358 -626 212 -167 211 -482 1248 3110 920 -954 -1268 -1093 516 939 -340 -1154 -26 856 -1145 -1462 -705 -11 1633 SS 20240619T105750.1Z 8936.456830 184 1 29.98 2 72.23 74.18 133.46 277.36 0.00 1 0.00 1 0 25 8.734e-02 9.279e-03 2.402e-02 1.578e-03 4.730449e-01 8.462591e-04 5.584201e-03 -6.000000e+00 5.305572e-02 232.95 -2.00 3.54 -2.00 319.67 0.00e+00 3.528849e-03 2.508179e-04 9.334377e-04 -6.000000e+00 2.353385e-03 285.98 -2.00 20.00 -2.00 318.94 0.00e+00 3.231 0.001 302.00 328.00 3 2.4271e+00 2.4399e-03 4.1207e-02 -6.0000e+00 1.3329e-01 2.3041e-02 2.8905e-03 2.5466e-02 -6.0000e+00 1.4363e-01 -6.0517e-02 2.2670e-03 1.3277e-02 -6.0000e+00 8.5412e-02 1.4162e-02 1.1696e-03 4.9497e-03 -6.0000e+00 3.5811e-02 1.0570e-03 -1.2911e-05 4.7872e-05 5.6810e-05 -6.0000e+00 2.5733e-03 -3.0841e-02 0.0000e+00 11 8 0 10 0 0 89.74 22.22 0.42 -0.03084 -0.03094 104 104 1 5 0 288.120 26.32 20.00 22.22 29.23 0.0 960.16 -38847 -26179 -22201 -29793 -27658 -20674 -33169 -24525 -28004 -30579 -28641 -21737 -7562 -16258 -9086 -4441 3740 1960 -1348 2046 -6008 2067 -3544 -473 -3433 -7126 -4399 -8383 -3786 -5050 2089 332 -382 -1203 -3575 -2227 -1612 278 -387 -1912 -2454 -2441 -1194 -2604 614 692 470 1709 -382 2048 2671 2598 2615 2291 1638 1120 -184 -710 -653 1153 2256 3367 2148 1611 -993 28 1952 2170 3551 1151 -445 -1094 -1083 -1009 -895 -593 -95 854 661 235 -1253 -1241 -1745 -1511 -182 -412 -178 -501 -322 -171 35 679 1398 1979 1607 461 483 258 -1279 -1735 -1154 -450 1281 1296 -1372 -1943 -1122 -759 504 392 -49 -518 -259 128 874 1742 2004 1560 703 -670 -967 -363 236 -142 399 -431 796 1953 842 -425 -600 -654 264 277 -24 -495 -34 85 -378 -587 -176 -48 738 -723 -507 -447 -646 -562 -369 -679 -513 -685 -823 -789 -602 -209 -603 -384 -210 182 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