File name: Pandora187s1_PittsburghPA_20250823_L2Fit_fout2c5d20230706p1-8.txt
File generation date: 20250824T053757.2Z
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_20250823_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: 20250823
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 20250823T121731.2Z 9366.512166 87 1 45.94 2 72.29 90.19 75.74 87.84 0.00 1 0.00 1 0 17 4.970e-02 5.928e-03 1.052e-02 8.374e-04 4.059161e-01 4.374003e-04 4.771116e-03 -6.000000e+00 2.931902e-02 230.98 -2.00 3.49 -2.00 319.41 0.00e+00 1.328419e-03 1.183073e-04 2.916860e-04 -6.000000e+00 1.303896e-03 288.65 -2.00 20.00 -2.00 318.63 0.00e+00 3.242 0.001 302.00 328.00 3 1.1249e+00 1.2382e-03 3.8128e-02 -6.0000e+00 7.3264e-02 -4.3028e-03 1.4562e-03 2.1682e-02 -6.0000e+00 7.8990e-02 -1.1309e-02 1.1040e-03 1.0538e-02 -6.0000e+00 4.7097e-02 -3.3024e-03 5.8139e-04 3.4375e-03 -6.0000e+00 2.0203e-02 4.5923e-03 -2.5394e-04 2.4983e-05 3.4818e-05 -6.0000e+00 1.3845e-03 -1.9708e-02 -9.7554e-06 10 0 0 10 0 0 88.63 17.80 0.33 -0.01971 -0.02162 572 176 1 5 0 80.290 21.27 15.01 17.80 29.52 32.8 972.47 -14200 -13145 -11560 -17292 -19030 -19474 -18635 -15475 -14400 -14296 -16348 -13072 -9700 -6238 -4793 -1074 -2184 -149 -1076 952 -153 -792 31 -340 -1192 -2313 -2241 -3713 -3582 -2264 -1157 -651 1315 -2129 -4806 -4730 -4006 -2903 -1810 -987 -1226 -585 -274 393 578 253 -158 112 -684 229 749 847 1100 1359 1236 1541 1247 531 529 704 979 1616 2261 2159 611 -6 -83 -360 280 537 626 709 698 984 576 270 -504 -1176 -1195 -1114 -1088 -1433 -2326 -1505 -758 -338 281 581 937 864 591 -9 -370 -247 -369 -379 515 808 82 -351 -556 -876 -74 35 -1075 -907 -668 -397 284 382 184 241 494 216 29 91 -264 -248 -299 -401 -404 22 292 255 287 -302 462 1113 772 740 503 298 153 249 -78 -357 7 -130 -261 -15 -270 -582 -285 -299 -275 -422 -429 -467 -472 -427 -443 -474 -566 -465 -390 -292 -263 -65 -146 -10 -81 74 -12 -64 3 -31 -115 -237 -233 -375 -345 -220 -123 -78 171 -302 -668 -650 -601 -507 -379 -242 -335 -168 -82 119 176 78 -49 34 -214 74 259 319 445 532 506 649 538 230 247 327 472 766 1179 1218 353 -3 -43 -191 161 351 446 525 512 685 370 157 -300 -696 -702 -753 -837 -1231 -2164 -1468 -723 -343 298 630 1006 887 613 -8 -337 -227 -373 -396 602 1049 112 -471 -696 -1007 -81 40 -1337 -1187 -918 -577 406 592 304 403 796 327 44 134 -397 -363 -469 -656 -660 35 448 375 436 -441 652 1638 1153 1200 865 531 283 453 -151 -723 15 -272 -544 -30 -517 -1075
SS 20250823T122309.6Z 9366.516083 90 1 45.91 2 71.22 91.11 74.71 88.74 0.00 1 0.00 1 0 17 3.655e-02 6.028e-03 7.210e-03 6.984e-04 3.854095e-01 3.648682e-04 4.579601e-03 -6.000000e+00 2.156282e-02 230.98 -2.00 3.49 -2.00 319.14 0.00e+00 1.320536e-03 9.015575e-05 1.937428e-04 -6.000000e+00 9.588169e-04 288.65 -2.00 20.00 -2.00 318.34 0.00e+00 3.068 0.000 302.00 328.00 3 1.0010e+00 1.0215e-03 3.6156e-02 -6.0000e+00 5.3883e-02 -3.7394e-03 1.1857e-03 2.0601e-02 -6.0000e+00 5.8090e-02 -1.1339e-02 8.5898e-04 1.0000e-02 -6.0000e+00 3.4636e-02 -2.5776e-03 4.5131e-04 3.2087e-03 -6.0000e+00 1.4861e-02 6.2709e-03 -3.8246e-05 2.0676e-05 3.3799e-05 -6.0000e+00 1.0178e-03 -2.0317e-02 1.6754e-05 10 0 0 10 0 0 55.14 17.81 0.33 -0.02032 -0.02060 671 206 1 5 0 68.410 21.27 15.00 17.81 30.19 32.7 976.26 -9816 -10382 -7669 -12161 -13382 -13532 -13850 -12189 -9427 -10108 -12361 -10088 -7248 -4847 -3031 -1084 -1498 -121 -519 851 -90 -684 -65 57 -1096 -1548 -1735 -3036 -3212 -1837 -916 -149 990 -1628 -4601 -4207 -3643 -2717 -1410 -1083 -1123 -706 -237 16 628 466 90 49 -549 96 810 611 1000 1087 1304 1469 1217 536 542 757 973 1691 2214 2175 652 21 -92 -474 160 641 539 577 582 977 422 296 -343 -1116 -865 -1176 -1107 -1477 -2303 -1626 -825 -463 251 537 770 773 549 -14 -336 -229 -345 -330 509 767 31 -390 -539 -918 -144 6 -994 -897 -641 -409 267 398 203 232 523 245 7 15 -181 -229 -196 -447 -455 18 363 222 420 -311 584 1149 827 754 473 331 221 294 -97 -321 14 -145 -293 -38 -298 -657 -244 -296 -225 -362 -365 -391 -425 -413 -350 -406 -518 -436 -354 -276 -201 -81 -121 -10 -47 80 -9 -67 -6 6 -126 -188 -213 -362 -365 -209 -114 -21 150 -265 -736 -662 -626 -544 -337 -304 -350 -232 -81 6 217 163 31 17 -193 35 312 233 408 473 589 683 579 256 254 352 470 882 1267 1343 411 12 -53 -272 100 450 414 460 460 733 293 185 -199 -643 -541 -847 -905 -1347 -2081 -1542 -833 -498 282 616 877 841 553 -13 -322 -222 -335 -360 621 957 41 -502 -701 -1099 -163 7 -1290 -1225 -849 -572 397 640 321 371 866 381 11 21 -257 -343 -314 -751 -765 29 572 336 604 -430 780 1598 1261 1244 768 556 384 541 -190 -613 27 -288 -576 -77 -580 -1233
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