File name: Pandora187s1_PittsburghPA_20250813_L2Fit_fout2c5d20230706p1-8.txt
File generation date: 20250814T053707.3Z
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: 187
Spectrometer number: 1
Processing software version used: BlickP v1.8.75
Instrument operation file used: Pandora187_OF_v4d20210517.txt
Instrument calibration file used: Pandora187s1_CF_v5d20230706.txt
Level 1 file used: Pandora187s1_PittsburghPA_20250813_L1_smca1c5d20230706p1-8.txt
Full location name: Pittsburgh, PA - Lawrenceville ACHD (USEPA AQS ID 42-003-0008)
Short location name: PittsburghPA
Country of location: United States
Location latitude [deg]: 40.4655
Location longitude [deg]: -79.9608
Location altitude [m]: 265
Local noon date: 20250813
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: None
First and last pixel inside fitting window: 194 335
Nominal wavelengths inside fitting window [nm]: 305.0595 305.2010 305.3424 305.4838 305.6252 305.7666 305.9080 306.0494 306.1908 306.3321 306.4735 306.6148 306.7561 306.8974 307.0387 307.1800 307.3213 307.4626 307.6038 307.7451 307.8863 308.0275 308.1687 308.3099 308.4511 308.5923 308.7335 308.8746 309.0158 309.1569 309.2980 309.4391 309.5802 309.7213 309.8624 310.0035 310.1445 310.2856 310.4266 310.5676 310.7086 310.8496 310.9906 311.1316 311.2726 311.4135 311.5545 311.6954 311.8363 311.9772 312.1181 312.2590 312.3999 312.5408 312.6816 312.8225 312.9633 313.1041 313.2449 313.3857 313.5265 313.6673 313.8080 313.9488 314.0895 314.2303 314.3710 314.5117 314.6524 314.7931 314.9338 315.0744 315.2151 315.3557 315.4963 315.6370 315.7776 315.9182 316.0587 316.1993 316.3399 316.4804 316.6210 316.7615 316.9020 317.0425 317.1830 317.3235 317.4640 317.6044 317.7449 317.8853 318.0257 318.1662 318.3066 318.4470 318.5873 318.7277 318.8681 319.0084 319.1488 319.2891 319.4294 319.5697 319.7100 319.8503 319.9905 320.1308 320.2710 320.4113 320.5515 320.6917 320.8319 320.9721 321.1123 321.2524 321.3926 321.5327 321.6728 321.8130 321.9531 322.0932 322.2333 322.3733 322.5134 322.6534 322.7935 322.9335 323.0735 323.2135 323.3535 323.4935 323.6335 323.7734 323.9134 324.0533 324.1932 324.3332 324.4731 324.6129 324.7528 324.8927
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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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting
Columns 242-383: 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
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SS 20250813T130435.6Z 9356.544856 263 1 8.78 2 61.75 94.89 66.50 259.80 0.00 1 0.00 1 0 17 1.215e-02 7.140e-03 1.131e-02 3.190e-03 2.739106e-01 1.658740e-03 3.318838e-03 -6.000000e+00 7.181818e-03 231.68 -2.00 3.49 -2.00 317.49 0.00e+00 9.060187e-04 2.531528e-04 6.288979e-05 -6.000000e+00 3.193184e-04 289.18 -2.00 20.00 -2.00 316.65 0.00e+00 2.102 0.000 302.00 328.00 3 3.5095e+00 4.4228e-03 2.5102e-02 -6.0000e+00 1.7974e-02 1.9393e-02 4.9591e-03 1.4513e-02 -6.0000e+00 1.9368e-02 -6.3740e-03 3.0032e-03 7.0435e-03 -6.0000e+00 1.1545e-02 -3.7899e-03 1.5050e-03 2.0604e-03 -6.0000e+00 4.9471e-03 1.4608e-03 -3.0604e-04 9.4095e-05 2.3431e-05 -6.0000e+00 3.3845e-04 -1.9574e-02 -3.4313e-05 12 9 1 12 1 1 98.89 17.83 0.35 -0.01957 -0.02187 14 24 1 5 0 583.200 21.27 14.98 17.83 31.48 32.7 987.07 -900 224 -685 -4110 -3674 -2114 -1377 -3506 -2057 -1827 -902 -3246 -501 -2314 41 598 1376 1246 139 2516 948 -195 38 1538 88 -336 -1296 -962 -1522 -190 537 514 1808 -1003 -3559 -2992 -3022 -2325 -1669 -775 -1076 -875 -430 22 157 -330 -110 -558 -253 222 1194 575 235 1239 902 1531 1330 587 780 833 648 1379 2059 1756 22 -182 -270 -557 1315 296 258 550 623 1287 391 213 209 -1034 -1691 -905 -1124 -1554 -2406 -1482 -903 -867 -191 507 656 272 -88 -171 -369 -5 -61 -129 619 1004 -178 -475 -826 -1163 -266 158 -1309 -822 -631 -197 398 595 114 330 799 239 65 197 -354 -141 -121 -429 -299 47 322 333 275 -122 923 1399 977 850 536 252 181 519 14 -398 -67 -132 -627 -246 -297 -796 -83 23 -72 -427 -339 -182 -123 -357 -230 -216 -106 -398 -67 -363 7 116 279 264 31 570 223 -46 9 384 23 -93 -364 -255 -379 -46 138 143 538 -316 -1086 -891 -981 -873 -679 -364 -556 -473 -238 12 87 -185 -60 -301 -134 118 665 346 150 826 623 1073 949 419 546 582 470 981 1582 1434 18 -138 -210 -428 979 251 239 526 592 1164 330 176 158 -762 -1336 -734 -1027 -1568 -2404 -1544 -1005 -1031 -237 641 824 328 -98 -188 -376 -5 -65 -143 757 1348 -234 -608 -1063 -1384 -304 189 -1715 -1128 -842 -275 583 927 174 502 1234 344 93 269 -494 -192 -177 -663 -465 72 474 468 368 -167 1212 1888 1322 1229 812 392 290 810 22 -693 -119 -238 -1132 -429 -499 -1298
SS 20250813T133227.1Z 9356.564202 288 1 5.19 2 56.50 99.82 71.52 264.56 0.00 1 0.00 1 0 25 1.048e-02 6.765e-03 3.251e-03 1.286e-03 2.364746e-01 6.696655e-04 2.873430e-03 -6.000000e+00 6.198763e-03 231.68 -2.00 3.49 -2.00 316.77 0.00e+00 5.478991e-04 8.440429e-05 5.372852e-05 -6.000000e+00 2.755796e-04 289.18 -2.00 20.00 -2.00 315.95 0.00e+00 1.806 0.000 302.00 328.00 3 1.6462e+00 1.7626e-03 2.1581e-02 -6.0000e+00 1.5514e-02 1.3090e-02 1.9656e-03 1.2479e-02 -6.0000e+00 1.6716e-02 -6.0483e-03 1.1491e-03 6.0503e-03 -6.0000e+00 9.9639e-03 -3.2481e-03 5.5206e-04 1.7295e-03 -6.0000e+00 4.2705e-03 1.3340e-02 -4.3143e-05 3.7703e-05 2.0353e-05 -6.0000e+00 2.9200e-04 -2.0021e-02 -1.1009e-05 12 9 1 12 1 1 98.30 17.82 0.34 -0.02002 -0.02035 67 185 1 5 0 76.180 21.27 15.01 17.82 32.27 32.9 992.44 -420 -849 -442 -2834 -3832 -2415 -1874 -516 -623 -1311 -2854 -1563 -765 -818 524 120 237 146 1282 1605 961 650 1648 1390 477 494 68 -553 -652 697 1074 1231 1529 -893 -3684 -2742 -2723 -1642 -897 -702 -1306 -858 -566 -388 159 -99 -342 -334 -787 84 871 500 766 883 977 1295 1085 472 643 724 1153 1371 1705 1843 71 -510 -562 -451 429 393 63 328 593 916 451 167 -401 -911 -473 -935 -991 -1552 -2259 -1549 -843 -501 34 279 607 343 247 -175 -453 -126 -131 -161 586 778 -22 -350 -524 -934 -220 183 -945 -739 -601 -466 361 502 333 310 591 232 125 138 -198 -185 -184 -381 -394 -77 283 195 385 -310 686 1392 901 941 541 337 234 389 14 -385 -14 -167 -379 -177 -457 -873 -59 -132 -71 -438 -532 -312 -252 -76 -102 -228 -501 -274 -147 -179 128 32 67 43 384 496 304 205 524 466 169 181 25 -193 -211 218 352 432 575 -353 -1406 -1015 -1098 -692 -448 -407 -832 -521 -352 -243 99 -61 -227 -216 -498 53 573 324 521 630 716 965 822 358 478 537 882 1125 1508 1583 61 -439 -450 -354 358 370 60 322 577 853 422 141 -309 -677 -370 -827 -981 -1563 -2430 -1740 -938 -595 42 355 764 413 295 -191 -456 -125 -138 -187 700 1018 -30 -466 -651 -1078 -263 214 -1206 -990 -842 -635 515 759 525 485 876 319 169 178 -261 -257 -257 -563 -589 -114 401 283 528 -406 858 1779 1238 1373 770 489 348 608 22 -627 -24 -284 -640 -289 -724 -1433
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