File name: Pandora187s1_PittsburghPA_20210916_L2Fit_fout2c2d20210902p1-8.txt File generation date: 20251128T073959.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Luke 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_v2d20210517.txt Instrument calibration file used: Pandora187s1_CF_v2d20210902.txt Level 1 file used: Pandora187s1_PittsburghPA_20210916_L1_smca1c2d20210902p1-8.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: 20210916 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]: 305.1270 305.2683 305.4097 305.5510 305.6924 305.8337 305.9750 306.1163 306.2576 306.3989 306.5402 306.6814 306.8227 306.9639 307.1051 307.2464 307.3876 307.5288 307.6699 307.8111 307.9523 308.0934 308.2346 308.3757 308.5168 308.6579 308.7990 308.9401 309.0812 309.2222 309.3633 309.5043 309.6454 309.7864 309.9274 310.0684 310.2094 310.3504 310.4914 310.6323 310.7733 310.9142 311.0551 311.1960 311.3369 311.4778 311.6187 311.7596 311.9004 312.0413 312.1821 312.3230 312.4638 312.6046 312.7454 312.8862 313.0269 313.1677 313.3084 313.4492 313.5899 313.7306 313.8713 314.0120 314.1527 314.2934 314.4341 314.5747 314.7154 314.8560 314.9966 315.1372 315.2778 315.4184 315.5590 315.6996 315.8401 315.9807 316.1212 316.2617 316.4022 316.5427 316.6832 316.8237 316.9642 317.1046 317.2451 317.3855 317.5259 317.6663 317.8067 317.9471 318.0875 318.2279 318.3682 318.5086 318.6489 318.7892 318.9295 319.0698 319.2101 319.3504 319.4907 319.6309 319.7712 319.9114 320.0516 320.1919 320.3321 320.4723 320.6124 320.7526 320.8928 321.0329 321.1730 321.3132 321.4533 321.5934 321.7335 321.8735 322.0136 322.1537 322.2937 322.4337 322.5738 322.7138 322.8538 322.9938 323.1337 323.2737 323.4137 323.5536 323.6935 323.8335 323.9734 324.1133 324.2532 324.3930 324.5329 324.6728 324.8126 324.9524 --------------------------------------------------------------------------------------- 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 --------------------------------------------------------------------------------------- SS 20210916T162827.8Z 7929.686433 1955 1 45.34 2 39.50 161.71 144.02 75.56 0.00 1 0.00 1 0 17 9.717e-03 7.566e-03 5.508e-03 3.007e-03 1.699046e-01 1.544490e-03 2.088516e-03 -6.000000e+00 5.625764e-03 228.99 -2.00 3.49 -2.00 315.94 0.00e+00 1.359981e-04 1.620568e-04 3.816396e-05 -6.000000e+00 2.523259e-04 286.73 -2.00 20.00 -2.00 315.18 0.00e+00 1.295 0.000 302.00 328.00 3 5.1959e+00 4.0080e-03 1.5377e-02 -6.0000e+00 1.3994e-02 4.1731e-02 4.4787e-03 8.8328e-03 -6.0000e+00 1.5179e-02 6.2669e-03 2.5642e-03 4.3244e-03 -6.0000e+00 9.0534e-03 -6.9448e-03 1.1706e-03 1.2076e-03 -6.0000e+00 3.8392e-03 7.0509e-04 9.4572e-05 8.7819e-05 1.5647e-05 -6.0000e+00 2.7155e-04 7.6370e-03 6.8188e-05 11 8 0 10 0 0 99.96 18.86 0.68 0.00764 0.00835 27 8 1 5 0 1677.820 22.19 15.00 18.86 31.59 10.6 1013.94 446 579 -2727 -1386 -3253 139 -141 -651 759 -1620 -543 274 920 971 438 6 150 534 268 1231 1396 156 1554 1061 621 96 -370 3 -296 872 1047 1297 1424 -1748 -3095 -2712 -1822 -832 -1091 -693 -1557 -651 -989 -470 -357 -549 -392 -1121 -1350 -38 222 252 702 731 1436 964 873 403 1228 598 1436 1832 2089 781 -46 -641 -681 678 415 524 500 366 425 778 -59 -375 -748 -476 -969 -1134 -1623 -2096 -1909 -1255 -452 -243 591 852 507 691 121 -483 425 -399 -368 -64 1157 222 113 -250 -825 -799 83 -335 -1103 -590 -477 364 653 698 195 492 296 -231 -393 -482 -349 -309 -291 -527 -260 244 -188 532 -275 -602 1372 838 1352 688 582 352 630 395 304 -303 20 -582 -140 -228 -551 -844 100 135 -635 -312 -676 28 -31 -160 198 -433 -140 74 273 322 160 2 58 213 110 511 575 65 661 474 289 45 -167 1 -116 339 426 558 637 -771 -1306 -1194 -903 -482 -679 -476 -1133 -482 -743 -350 -263 -397 -273 -755 -891 -26 156 187 540 580 1146 784 711 324 970 485 1222 1669 2009 763 -42 -534 -537 542 371 517 519 385 435 746 -52 -324 -600 -383 -860 -1023 -1615 -2239 -2127 -1480 -568 -295 739 1070 619 854 137 -495 408 -397 -398 -76 1492 281 142 -323 -991 -911 97 -423 -1490 -759 -638 503 947 1054 297 717 399 -311 -495 -601 -452 -430 -398 -746 -365 332 -269 715 -354 -736 1636 1056 1795 958 826 507 859 570 461 -475 31 -944 -221 -350 -820 -1238 SS 20210916T163812.4Z 7929.693199 2013 1 45.38 2 38.98 165.47 142.30 77.60 0.00 1 0.00 1 0 25 1.231e-02 8.630e-03 7.659e-03 4.105e-03 1.742526e-01 2.097221e-03 2.139362e-03 -6.000000e+00 7.125947e-03 228.98 -2.00 3.49 -2.00 315.92 0.00e+00 2.579762e-04 2.215837e-04 3.642566e-05 -6.000000e+00 3.196195e-04 286.73 -2.00 20.00 -2.00 315.18 0.00e+00 1.285 0.000 302.00 328.00 3 5.7852e+00 5.4488e-03 1.5450e-02 -6.0000e+00 1.7726e-02 5.7793e-02 6.0901e-03 9.0746e-03 -6.0000e+00 1.9227e-02 6.8507e-05 3.4936e-03 4.4334e-03 -6.0000e+00 1.1468e-02 -3.2387e-03 1.5893e-03 1.2428e-03 -6.0000e+00 4.8628e-03 3.8894e-04 9.7169e-05 1.2021e-04 1.6331e-05 -6.0000e+00 3.4397e-04 7.7711e-03 6.6062e-05 11 8 0 10 0 0 99.88 18.87 0.96 0.00777 0.00850 15 5 1 5 0 3024.610 22.19 15.00 18.87 31.91 10.6 1015.82 1297 1120 -1330 -2779 -1156 -476 4117 -863 4410 -4820 218 -242 1691 17 355 -194 253 670 378 1624 825 400 1020 948 -811 -145 -322 2122 -970 528 169 62 956 -2175 -2620 -2970 -2489 -2540 -257 -657 -984 -1342 -158 -758 610 -852 159 -1741 -1503 324 666 483 277 1161 2071 1246 636 -83 859 697 757 1982 2462 1583 -263 -1064 -1047 -60 747 37 746 614 178 522 -26 -647 -1326 -688 -1483 -1870 -1273 -1325 -2229 -1074 -53 -71 930 1036 971 1094 -50 -185 355 -861 -643 120 1280 578 -689 -211 -1098 -932 -217 -570 -1152 -840 -589 -52 1356 569 498 609 300 -417 -905 -674 -482 -244 118 -260 -447 605 -335 383 -649 -267 1159 924 894 676 738 343 717 483 144 -150 488 -440 -509 -272 -336 -964 307 276 -325 -613 -227 -93 836 -205 1065 -1278 54 -63 480 5 125 -72 95 257 149 647 329 160 420 408 -367 -66 -140 825 -367 198 67 26 414 -927 -1059 -1261 -1194 -1441 -167 -477 -752 -968 -114 -597 471 -653 116 -1247 -1050 227 493 377 226 968 1735 1067 548 -70 718 595 684 1743 2281 1484 -232 -939 -876 -51 703 35 748 622 177 484 -24 -536 -1024 -532 -1268 -1791 -1332 -1357 -2408 -1221 -64 -90 1221 1368 1243 1298 -54 -199 359 -907 -673 138 1592 767 -915 -263 -1276 -1026 -244 -695 -1499 -1137 -828 -76 1893 835 735 930 425 -543 -1104 -811 -603 -327 168 -384 -660 862 -461 495 -803 -313 1330 1117 1145 904 1004 475 1022 729 212 -227 750 -687 -778 -435 -520 -1476 SS 20210916T164019.9Z 7929.694675 2017 1 45.17 2 38.88 166.30 141.92 78.03 0.00 1 0.00 1 0 17 1.288e-02 9.164e-03 1.031e-02 5.297e-03 1.784813e-01 2.720432e-03 2.167695e-03 -6.000000e+00 7.457435e-03 228.98 -2.00 3.49 -2.00 316.07 0.00e+00 1.974810e-04 2.950633e-04 5.176459e-05 -6.000000e+00 3.345291e-04 286.73 -2.00 20.00 -2.00 315.32 0.00e+00 1.283 0.000 302.00 328.00 3 6.1025e+00 7.0861e-03 1.5541e-02 -6.0000e+00 1.8550e-02 6.7752e-02 7.9290e-03 9.2264e-03 -6.0000e+00 2.0122e-02 -8.6351e-04 4.5527e-03 4.5137e-03 -6.0000e+00 1.2002e-02 -3.8869e-03 2.0824e-03 1.2670e-03 -6.0000e+00 5.0887e-03 2.8019e-04 2.0595e-05 1.5566e-04 1.5983e-05 -6.0000e+00 3.6003e-04 7.6830e-03 3.0594e-05 11 8 0 10 0 0 99.97 18.87 1.38 0.00768 0.00784 15 5 1 5 0 3010.770 22.19 15.00 18.87 31.93 10.6 1015.97 -1203 3566 -2236 570 -4012 152 3052 -2077 2594 -3311 1248 -872 2124 1149 -592 -1807 395 92 1704 974 2070 265 2368 1588 271 -378 -925 2211 -2432 1472 32 1226 657 -1055 -2543 -2403 -1567 -2423 -1171 486 -1856 -895 77 -484 695 -933 -28 -2317 -2154 56 223 -661 -290 422 1784 965 686 48 1474 516 743 2689 2397 698 728 -1106 -380 122 -52 594 394 997 35 -237 -547 -936 -1132 -783 -1246 -1170 -1724 -1680 -1793 -1058 -544 -533 1602 1399 1521 649 -150 -444 541 -960 -453 20 1608 839 143 61 -1269 -996 -156 -451 -212 -881 -1046 12 1284 639 511 1099 387 -828 -970 -1495 -455 -791 89 -218 -311 363 -360 381 -385 -804 725 617 463 232 830 668 465 922 429 -290 295 8 -109 -340 -773 -795 -254 814 -523 115 -770 28 596 -475 608 -824 290 -218 573 350 -201 -651 141 34 635 374 781 102 922 651 116 -165 -387 823 -895 526 12 489 275 -428 -988 -977 -717 -1323 -742 336 -1378 -676 59 -366 515 -689 -20 -1608 -1460 38 160 -503 -230 343 1447 801 571 40 1182 426 648 2471 2340 696 671 -944 -305 100 -48 597 418 1061 36 -234 -489 -751 -842 -585 -1028 -1076 -1752 -1822 -2034 -1163 -639 -662 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