File name: Pandora51s1_OldFieldNY_20221201_L2Fit_fout2c5d20211018p1-8.txt File generation date: 20251205T033759.3Z 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 v1.8.75 Instrument operation file used: Pandora51_OF_v5d20190801.txt Instrument calibration file used: Pandora51s1_CF_v5d20211018.txt Level 1 file used: Pandora51s1_OldFieldNY_20221201_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: 20221201 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 20221201T131304.4Z 8370.550745 87 1 48.71 2 79.27 131.77 141.67 35.96 0.00 1 0.00 1 0 25 4.863e-01 8.216e-03 3.308e-01 5.423e-03 6.879473e-01 3.077137e-03 7.810611e-03 -6.000000e+00 2.903196e-01 223.00 -2.00 3.51 -2.00 321.43 0.00e+00 4.897889e-03 1.551608e-03 1.429197e-03 -6.000000e+00 1.281646e-02 278.73 -2.00 20.00 -2.00 320.95 0.00e+00 5.169 0.002 302.00 328.00 3 2.3976e+00 1.0667e-02 6.4186e-02 -6.0000e+00 7.1359e-01 5.1161e-02 1.5307e-02 4.1077e-02 -6.0000e+00 7.7443e-01 -5.0185e-02 1.6462e-02 2.1152e-02 -6.0000e+00 4.6046e-01 6.8985e-03 7.7484e-03 9.2424e-03 -6.0000e+00 1.9733e-01 1.3621e-04 -1.2770e-03 1.6848e-04 1.0529e-04 -6.0000e+00 1.5040e-02 3.9514e-03 -8.1613e-05 11 9 0 11 8 0 98.04 22.22 0.36 0.00395 -0.00564 86 20 1 5 0 566.230 26.83 20.00 22.22 6.93 14.4 889.22 -158965 -188592 -119212 -93751 -154269 900000 -239036 -11679 -176964 -114980 180535 7675 -47620 -115094 -38656 7538 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-267 1424 -575 -248 36 -828 -384 -961 -116 -960 132 -224 -41 142 101 470 438 1106 -855 1038 -95 -276 -884 -1069 450 797 -360 -1362 -355 -1189 -514 -178 49 -681 -760 604 -482 1368 2074 668 1023 -869 -582 -1033 1325 -418 264 662 323 1921 928 396 -650 -1061 471 464 -153 -53 -745 -509 573 -1239 318 1 392 900000 SS 20221201T131850.6Z 8370.554752 90 1 48.77 2 78.46 132.86 141.02 37.89 0.00 1 0.00 1 0 25 2.999e-01 6.317e-03 2.803e-01 4.957e-03 6.555106e-01 2.790674e-03 7.467270e-03 -6.000000e+00 1.791173e-01 223.00 -2.00 3.51 -2.00 321.27 0.00e+00 3.853813e-03 1.348474e-03 1.357282e-03 -6.000000e+00 7.891233e-03 278.73 -2.00 20.00 -2.00 320.79 0.00e+00 4.837 0.002 302.00 328.00 3 2.6412e+00 9.4242e-03 6.0189e-02 -6.0000e+00 4.4088e-01 2.5257e-02 1.3221e-02 3.8300e-02 -6.0000e+00 4.7858e-01 -1.2382e-02 1.4065e-02 1.9632e-02 -6.0000e+00 2.8432e-01 -8.8695e-03 6.7006e-03 8.2250e-03 -6.0000e+00 1.2184e-01 1.5116e-04 -1.1576e-03 1.5503e-04 9.4211e-05 -6.0000e+00 9.3946e-03 3.7664e-03 -4.6329e-05 11 1 0 11 8 0 99.75 22.22 0.26 0.00377 -0.00493 81 18 1 5 0 601.980 26.83 20.00 22.22 7.09 14.4 890.31 -124700 -49058 -131393 -1244 -83018 -109863 900000 -55504 -118439 -36129 -145871 -81996 900000 -68031 15124 -26284 -32265 -63154 -38017 -38674 -9227 42219 3861 -24127 -8243 26264 -11767 -16851 -16371 18042 691 -5011 -10842 -16193 4909 -8870 -9888 11879 -4137 -2390 3180 -4290 -10136 1915 -2529 219 1481 -2517 3470 3781 9741 -457 5448 4443 6435 4483 3079 2643 -800 -349 -90 2394 2739 1860 3748 976 1304 2029 644 -1 -617 1298 -2315 475 -1819 -326 -891 -1201 -266 -133 -484 -1752 -1321 -1963 -817 -505 -998 630 124 -4 -530 145 1327 1257 -468 645 1373 232 -402 -222 54 4 764 -4 -1862 -186 -884 -132 -719 463 188 -217 131 150 449 574 447 302 145 -524 -775 450 403 -90 -440 304 1050 1038 304 -430 -432 17 133 -222 -394 -290 244 238 -239 -100 10 307 900000 -646 -237 -862 -6 -401 -569 900000 -268 -940 -175 -1863 -679 900000 -822 107 -308 -457 -1261 -682 -734 -134 379 55 -491 -154 363 -240 -361 -367 330 18 -153 -395 -642 157 -343 -443 517 -256 -169 237 -346 -909 157 -222 19 134 -249 345 411 1118 -65 796 708 1061 782 553 472 -145 -64 -18 512 660 494 1003 266 361 594 214 0 -237 499 -951 177 -631 -102 -274 -393 -99 -58 -232 -953 -775 -1236 -543 -354 -731 460 90 -3 -344 89 848 859 -347 547 1330 253 -464 -250 56 4 683 -4 -1860 -193 -985 -158 -957 678 299 -360 214 235 669 834 662 470 236 -878 -1278 707 612 -131 -623 414 1420 1507 498 -791 -862 37 280 -500 -940 -721 615 605 -599 -239 24 699 900000 SS 20221201T132400.1Z 8370.558334 93 1 19.12 2 77.76 133.85 140.42 39.57 0.00 1 0.00 1 0 25 3.806e-01 1.072e-02 2.375e-01 6.453e-03 6.234201e-01 3.572897e-03 7.306573e-03 -6.000000e+00 2.272646e-01 223.00 -2.00 3.51 -2.00 320.91 0.00e+00 2.678503e-03 1.559691e-03 2.163106e-03 -6.000000e+00 1.053350e-02 278.73 -2.00 20.00 -2.00 320.41 0.00e+00 4.579 0.002 302.00 328.00 3 3.1307e+00 1.1418e-02 5.7418e-02 -6.0000e+00 5.5907e-01 7.0853e-02 1.5174e-02 3.7415e-02 -6.0000e+00 6.0725e-01 -9.7550e-02 1.5184e-02 1.7661e-02 -6.0000e+00 3.6048e-01 3.3776e-02 7.4140e-03 6.4267e-03 -6.0000e+00 1.5582e-01 1.2199e-04 -1.5332e-03 1.9960e-04 7.5937e-05 -6.0000e+00 1.1846e-02 4.5534e-03 -1.1827e-04 12 9 9 12 9 1 99.75 22.23 0.46 0.00455 -0.00697 17 11 1 5 0 1051.140 26.83 20.00 22.23 7.30 14.4 891.93 900000 -169814 -43034 -124447 -14926 900000 -150540 10730 -152671 900000 -129195 -12611 -82599 -47670 49411 -45356 231560 -45474 -30000 -37652 36273 -7825 -11317 18156 -35201 -7980 -46778 19282 -20083 -2943 -13438 -9098 36068 -15109 20375 -15514 19042 3341 -951 13865 -4468 18322 -9697 8520 152 826 2921 -7041 12034 8620 8133 2375 5493 1078 3070 1608 -5419 4655 -1874 5020 343 -1363 1704 -624 1967 2406 5684 -1097 4528 496 1265 2013 -664 4122 -1226 2944 892 1595 3330 -2000 286 -2539 -1947 -3537 -1597 -608 -570 300 824 243 -757 507 551 1234 762 -348 1856 -1193 -853 -956 925 -764 655 944 -2157 100 -1874 -81 21 -272 -843 -112 -201 75 1336 48 1276 134 -619 -494 -272 598 -99 269 339 894 936 979 364 -44 121 757 114 -8 -60 -771 110 217 -576 -39 -97 -135 900000 900000 -3003 -271 -1461 -94 900000 -2367 67 -3060 900000 -2437 -95 -1593 -819 394 -1016 1456 -1251 -755 -1065 532 -184 -294 381 -1259 -241 -1949 437 -699 -97 -549 -415 1240 -831 829 -890 883 218 -78 1139 -486 1692 -1162 924 18 101 359 -938 1490 1203 1194 408 1000 221 647 356 -1305 1000 -422 1066 81 -366 498 -203 635 763 1762 -386 1685 216 586 944 -310 1715 -490 1033 309 580 1358 -1008 162 -1568 -1292 -2542 -1202 -479 -467 247 665 187 -552 346 371 878 615 -327 1957 -1368 -1020 -1117 1039 -797 642 948 -2373 114 -2192 -100 28 -412 -1320 -179 -319 119 2001 71 1900 211 -1033 -840 -455 957 -154 401 485 1232 1285 1437 600 -78 228 1502 240 -17 -136 -1822 263 523 -1378 -90 -210 -291 900000 SS 20221201T132933.6Z 8370.562194 96 1 47.94 2 77.01 134.92 139.75 41.34 0.00 1 0.00 1 0 17 4.217e-01 2.104e-02 3.455e-01 1.462e-02 5.819221e-01 7.984349e-03 6.651950e-03 -6.000000e+00 2.508258e-01 223.00 -2.00 3.51 -2.00 321.06 0.00e+00 9.737672e-03 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