File name: Pandora51s1_OldFieldNY_20231207_L2Fit_fout2c5d20211018p1-8.txt File generation date: 20240113T145857.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 51 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora51_OF_v5d20190801.txt Instrument calibration file used: Pandora51s1_CF_v5d20211018.txt Level 1 file used: Pandora51s1_OldFieldNY_20231207_L1_smca1c5d20211018p1-8.txt Full location name: Flax Pond NYSDEC (USEPA AQS ID 36-103-0044) Short location name: OldFieldNY Country of location: USA Location latitude [deg]: 40.9635 Location longitude [deg]: -73.1402 Location altitude [m]: 3 Local noon date: 20231207 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 3 - Full Lab Cal on 1.8 for HCHO First and last pixel inside fitting window: 257 399 Nominal wavelengths inside fitting window [nm]: 305.1342 305.2748 305.4155 305.5562 305.6968 305.8375 305.9781 306.1187 306.2593 306.3999 306.5405 306.6810 306.8216 306.9621 307.1027 307.2432 307.3837 307.5242 307.6647 307.8052 307.9457 308.0861 308.2266 308.3670 308.5074 308.6478 308.7882 308.9286 309.0690 309.2094 309.3497 309.4901 309.6304 309.7707 309.9110 310.0513 310.1916 310.3319 310.4722 310.6124 310.7527 310.8929 311.0331 311.1733 311.3135 311.4537 311.5939 311.7340 311.8742 312.0143 312.1545 312.2946 312.4347 312.5748 312.7149 312.8549 312.9950 313.1350 313.2751 313.4151 313.5551 313.6951 313.8351 313.9751 314.1151 314.2550 314.3950 314.5349 314.6748 314.8147 314.9546 315.0945 315.2344 315.3743 315.5141 315.6540 315.7938 315.9336 316.0734 316.2132 316.3530 316.4928 316.6326 316.7723 316.9120 317.0518 317.1915 317.3312 317.4709 317.6106 317.7503 317.8899 318.0296 318.1692 318.3088 318.4484 318.5880 318.7276 318.8672 319.0068 319.1463 319.2859 319.4254 319.5649 319.7044 319.8439 319.9834 320.1229 320.2624 320.4018 320.5413 320.6807 320.8201 320.9595 321.0989 321.2383 321.3777 321.5170 321.6564 321.7957 321.9351 322.0744 322.2137 322.3530 322.4922 322.6315 322.7708 322.9100 323.0492 323.1885 323.3277 323.4669 323.6061 323.7452 323.8844 324.0235 324.1627 324.3018 324.4409 324.5800 324.7191 324.8582 324.9973 --------------------------------------------------------------------------------------- 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 20231207T140403.3Z 8741.586149 287 1 48.55 2 73.62 141.82 49.81 211.88 0.00 1 0.00 1 0 17 2.810e-01 1.484e-02 2.040e-01 1.061e-02 5.056889e-01 5.797472e-03 5.970591e-03 -6.000000e+00 1.673739e-01 222.91 -2.00 3.51 -2.00 320.30 0.00e+00 4.128636e-03 2.044581e-03 4.483476e-04 -6.000000e+00 8.297768e-03 278.07 -2.00 20.00 -2.00 319.75 0.00e+00 3.488 0.001 302.00 328.00 3 5.1779e+00 1.7114e-02 4.3466e-02 -6.0000e+00 4.1231e-01 1.4280e-01 2.0983e-02 2.6442e-02 -6.0000e+00 4.4836e-01 -8.3128e-02 1.8630e-02 1.4273e-02 -6.0000e+00 2.6566e-01 2.6146e-02 9.5279e-03 6.0504e-03 -6.0000e+00 1.1534e-01 4.7204e-05 -1.5852e-03 3.4298e-04 7.3765e-05 -6.0000e+00 8.7635e-03 1.0420e-02 -2.1594e-04 12 9 8 11 8 0 99.96 22.16 0.55 0.01042 -0.00149 22 5 1 5 0 2206.260 26.83 20.00 22.16 6.60 17.9 896.80 -77138 900000 900000 8606 900000 -33659 238494 -9850 900000 900000 -13272 -8684 -93914 67669 -63868 85095 -10667 6528 44213 21546 9430 -19540 49291 -5433 -2121 11860 -15463 38466 -24849 17984 -15199 55258 -6380 -5057 -2297 -10162 -10327 -12064 8907 -7345 6700 287 6636 -4724 534 9838 -6710 18164 6367 -66 -4669 -1375 13135 -964 8168 2673 6695 1261 -1624 5568 -4883 11676 -5488 8735 1807 -4627 1430 3444 3083 -894 1986 -3683 -213 -2246 2218 -1585 -1699 1586 2576 -1135 -3415 -2827 -2730 85 1024 -688 845 -695 -130 1495 -1335 -1836 -269 1392 12 704 1032 857 -588 -762 44 370 1473 -2510 -183 -1904 -2203 1015 -159 816 30 99 -326 -253 -261 596 885 371 -90 -660 392 553 1169 248 -251 649 951 2080 -1367 -386 -212 523 554 -557 64 -1514 984 59 -220 412 -348 -313 900000 -1779 900000 900000 94 900000 -527 2465 -146 900000 900000 -248 -182 -5138 1030 -3784 1466 -483 268 1347 828 412 -1131 1582 -303 -120 613 -1011 1507 -1779 949 -1253 2691 -594 -467 -202 -1011 -1138 -1606 1141 -1231 1086 51 1175 -930 101 1764 -1402 3096 1267 -15 -1182 -366 3256 -291 2336 827 2001 392 -511 1694 -1712 3831 -2361 3466 766 -2023 584 1440 1434 -481 1108 -2209 -120 -1203 1060 -717 -737 692 1251 -659 -2251 -2047 -2114 68 864 -623 783 -662 -121 1295 -1105 -1430 -206 1095 11 688 1138 1041 -750 -943 50 385 1496 -2681 -203 -2262 -2780 1327 -229 1263 49 167 -536 -394 -382 841 1267 560 -143 -1085 631 863 1750 358 -357 882 1275 2916 -2125 -648 -379 973 1075 -1153 137 -3386 2190 134 -491 898 -727 -627 900000 SS 20231207T141727.5Z 8741.595458 294 1 49.07 2 72.10 144.64 51.24 215.71 0.00 1 0.00 1 0 25 1.456e-01 7.693e-03 1.056e-01 4.592e-03 4.691884e-01 2.450231e-03 5.561239e-03 -6.000000e+00 8.626139e-02 222.91 -2.00 3.51 -2.00 320.07 0.00e+00 9.254522e-04 7.993568e-04 6.874862e-04 -6.000000e+00 3.797488e-03 278.07 -2.00 20.00 -2.00 319.51 0.00e+00 3.211 0.001 302.00 328.00 3 4.0728e+00 7.1098e-03 4.0230e-02 -6.0000e+00 2.1212e-01 5.1992e-02 8.6026e-03 2.4856e-02 -6.0000e+00 2.3016e-01 -4.8254e-04 7.4219e-03 1.2483e-02 -6.0000e+00 1.3725e-01 -9.5711e-03 3.8229e-03 3.9880e-03 -6.0000e+00 5.8978e-02 2.0201e-04 -3.4751e-04 1.4768e-04 5.0308e-05 -6.0000e+00 4.4812e-03 8.1999e-03 3.9370e-05 11 9 0 11 8 0 99.99 22.17 0.21 0.00820 0.00559 111 25 1 5 0 441.950 26.83 20.01 22.17 6.76 17.9 897.98 -888 -52296 97410 -43705 -9503 -62942 -38942 22450 33000 -18746 -37187 36076 35222 20358 -17444 -6302 -9578 -4992 16244 -5710 16514 -11078 461 -2831 -5540 -5225 -18725 11615 -7855 13288 -8923 15700 7401 -4466 4208 -924 6494 -5280 4444 -4649 764 -1466 -2062 314 -2516 2244 -673 3724 936 -793 1191 -1362 3602 961 3269 -292 483 812 -1089 1643 444 2799 781 219 -751 -326 2146 1516 2497 -414 562 -728 -1718 -72 129 1917 580 1857 -25 -660 -2361 -2110 -2023 -1355 317 -65 -155 -250 143 -27 318 1402 803 1607 170 1063 300 474 -277 -807 22 156 1118 -560 -923 -1310 -691 -3 -288 343 -525 19 -149 271 483 840 1020 -416 220 -1244 -549 97 137 521 -491 862 1143 1576 235 -263 -90 -126 336 4 -44 -471 -91 122 -163 69 -371 159 900000 -12 -1200 576 -875 -138 -1506 -838 305 443 -420 -1072 614 707 555 -770 -280 -478 -256 732 -323 782 -689 27 -185 -384 -372 -1507 687 -567 840 -776 1239 669 -458 388 -94 700 -745 680 -869 147 -305 -445 67 -558 478 -149 821 213 -196 314 -401 1087 316 1095 -104 173 286 -385 572 166 1119 350 105 -360 -150 950 704 1272 -242 348 -465 -1079 -42 68 906 264 861 -13 -402 -1656 -1630 -1672 -1151 282 -61 -153 -249 140 -26 280 1142 638 1318 156 1094 341 591 -360 -1021 25 172 1177 -623 -1096 -1602 -887 -4 -424 546 -891 33 -247 423 707 1190 1466 -636 352 -2078 -905 155 210 786 -715 1189 1554 2247 371 -442 -161 -235 649 8 -93 -1034 -204 276 -363 152 -778 320 900000 SS 20231207T142237.7Z 8741.599048 297 1 48.84 2 71.55 145.75 51.83 217.15 0.00 1 0.00 1 0 25 4.174e-02 5.752e-03 1.355e-02 8.883e-04 4.526684e-01 4.670124e-04 5.370638e-03 -6.000000e+00 2.472963e-02 222.91 -2.00 3.51 -2.00 319.69 0.00e+00 1.160970e-03 1.378557e-04 3.681504e-04 -6.000000e+00 1.089286e-03 278.07 -2.00 20.00 -2.00 319.12 0.00e+00 3.120 0.001 302.00 328.00 3 1.7685e+00 1.3171e-03 3.8825e-02 -6.0000e+00 6.0808e-02 4.9958e-02 1.5672e-03 2.3520e-02 -6.0000e+00 6.5991e-02 -1.6269e-02 1.3089e-03 1.1924e-02 -6.0000e+00 3.9353e-02 -5.0210e-03 6.8507e-04 3.8048e-03 -6.0000e+00 1.6903e-02 2.2760e-03 -6.8310e-04 2.8155e-05 4.6953e-05 -6.0000e+00 1.2853e-03 8.7720e-03 -6.2215e-05 10 0 0 10 0 0 99.96 22.17 0.22 0.00877 0.00364 444 101 1 5 0 109.980 26.83 20.00 22.17 6.84 17.9 898.69 -16658 -11829 -13472 -18962 -11077 -14212 -8480 -20652 -10365 -12261 -6766 -7038 -6167 -3025 -5018 -281 -1202 -1591 -376 -330 -1582 -1224 8 -2648 -706 -3182 -2804 -3344 -2529 1130 -685 1582 -1848 -2989 -2891 -426 -749 -1370 3 -2096 -1415 -2002 -832 -984 -440 -382 -471 465 175 1448 1403 1229 1313 989 942 479 499 -63 492 896 1641 1997 1313 568 -387 379 1029 1295 1378 226 -16 -366 -131 -132 -350 -57 158 645 360 -585 -1060 -1521 -1868 -1038 -807 -626 -333 -143 24 151 646 803 1238 1397 931 801 632 129 -764 -489 -332 467 765 15 -1006 -1155 -600 -320 -26 -76 -444 -365 -90 289 675 1089 913 329 -186 -793 -404 -36 131 115 264 395 1141 1290 188 -93 -349 -88 173 -29 -214 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