File name: Pandora51s1_OldFieldNY_20220829_L2Fit_fout2c5d20211018p1-8.txt File generation date: 20251205T031131.6Z 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_20220829_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: 20220829 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 20220829T115127.1Z 8276.494064 531 1 4.60 2 73.03 92.42 96.65 81.26 0.00 1 0.00 1 0 17 4.121e-01 1.697e-02 2.532e-01 1.454e-02 4.577666e-01 7.686619e-03 5.366111e-03 -6.000000e+00 2.470877e-01 230.69 -2.00 3.51 -2.00 319.68 0.00e+00 3.842492e-03 2.319064e-03 1.117099e-03 -6.000000e+00 1.119120e-02 289.23 -2.00 20.00 -2.00 318.87 0.00e+00 3.374 0.001 302.00 328.00 3 4.4636e+00 2.2337e-02 4.1578e-02 -6.0000e+00 6.1599e-01 4.9230e-02 2.6566e-02 2.4205e-02 -6.0000e+00 6.6729e-01 -6.8617e-02 2.0466e-02 1.2612e-02 -6.0000e+00 3.9834e-01 2.0088e-02 1.0541e-02 4.5907e-03 -6.0000e+00 1.6570e-01 1.2100e-04 -8.8785e-04 4.5535e-04 5.7084e-05 -6.0000e+00 1.2687e-02 -1.0371e-03 2.4320e-05 12 9 9 12 1 1 999.00 22.18 0.40 -0.00104 -0.00771 1 5 1 5 0 2211.320 26.83 20.00 22.18 30.07 14.4 1038.42 45892 83875 403032 -38588 12719 -39569 122829 -47097 -1954 -24445 31932 -42915 -25290 30973 88274 60932 -32182 73418 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114 -863 -1770 1549 -885 -1311 -1349 -2434 715 -3689 895 -1165 1612 -1639 1330 -222 -635 620 -2687 1169 743 -80 -1724 2600 1978 2618 754 -1911 -277 -2071 -1339 343 -1061 974 -2266 650 1241 1085 -964 1017 -1194 1121 751 858 3453 -2489 -921 -1081 875 3016 -1030 -846 426 1207 545 -609 531 -602 15 -5151 1193 -1009 405 714 -183 802 -808 552 -382 1210 SS 20220829T115227.5Z 8276.494762 533 1 48.75 2 72.85 92.58 96.47 81.43 0.00 1 0.00 1 0 25 1.571e-01 9.519e-03 2.001e-01 8.509e-03 4.417857e-01 4.568335e-03 5.020482e-03 -6.000000e+00 9.421262e-02 230.69 -2.00 3.51 -2.00 320.39 0.00e+00 1.127299e-04 1.697629e-03 3.786027e-04 -6.000000e+00 4.302662e-03 289.23 -2.00 20.00 -2.00 319.61 0.00e+00 3.339 0.001 302.00 328.00 3 4.8964e+00 1.4239e-02 4.0785e-02 -6.0000e+00 2.3485e-01 -8.1206e-02 1.7600e-02 2.3501e-02 -6.0000e+00 2.5445e-01 7.7234e-02 1.4355e-02 1.1349e-02 -6.0000e+00 1.5190e-01 -4.0232e-02 7.1756e-03 3.1691e-03 -6.0000e+00 6.3559e-02 8.6425e-05 -1.8049e-04 2.8229e-04 4.0372e-05 -6.0000e+00 4.8514e-03 -1.0578e-03 5.8051e-05 12 9 8 11 8 0 99.99 22.18 0.11 -0.00106 -0.00241 61 14 1 5 0 799.060 26.83 20.00 22.18 30.08 14.4 1038.27 900000 -41736 53360 -99369 65757 -62882 24114 -12623 -2041 -18787 -47808 24366 10658 17001 49253 -4326 29817 9567 -2478 -6316 3196 9559 5675 -4488 -17130 13115 -22125 9989 4801 5463 -13748 26438 -7085 -7227 11422 -4612 -1222 -3936 1995 1940 -2973 1674 -1625 -3916 -1282 2415 -1418 -2047 2098 -278 5776 -2184 4769 -2014 -2639 769 -1137 5522 -2071 953 -1507 4535 -1473 948 1123 727 4996 -67 1895 -954 -639 1673 1112 -419 782 748 -534 1689 1358 -1262 -1084 -859 -617 -2334 -964 -1157 192 -570 629 263 856 812 2091 2604 2526 347 1102 314 -116 -1566 390 -562 740 131 -2128 -1692 -1511 9 -726 108 -1391 -533 -188 118 679 185 1054 15 689 117 -292 -298 -15 1614 103 437 662 1741 569 152 307 -679 968 -583 -50 -262 125 -156 -183 -670 177 -63 101 900000 -693 443 -2685 546 -1212 239 -200 -32 -364 -1247 385 225 394 1003 -156 855 353 -110 -296 144 416 275 -254 -1144 691 -1604 536 264 320 -1072 1595 -634 -658 873 -424 -121 -481 269 303 -534 304 -316 -792 -255 468 -287 -423 428 -62 1319 -575 1263 -609 -840 245 -375 1694 -678 307 -525 1633 -618 412 485 303 1962 -29 883 -512 -369 968 635 -230 389 339 -233 752 655 -716 -696 -609 -469 -1877 -819 -1047 179 -546 588 241 724 640 1568 2004 2136 339 1174 371 -143 -1907 446 -600 754 139 -2478 -2072 -1906 12 -1042 167 -2301 -887 -302 178 986 262 1500 23 1070 190 -475 -474 -24 2392 149 602 896 2439 878 255 548 -1250 1826 -1178 -106 -583 285 -360 -420 -1493 375 -128 205 SS 20220829T120138.8Z 8276.501144 562 1 11.47 2 71.11 94.13 94.83 82.94 0.00 1 0.00 1 0 25 1.289e-01 1.013e-02 9.899e-02 8.078e-03 4.048003e-01 4.247427e-03 4.680546e-03 -6.000000e+00 7.734729e-02 230.68 -2.00 3.51 -2.00 319.44 0.00e+00 3.475323e-04 1.177767e-03 3.858437e-04 -6.000000e+00 3.502440e-03 289.23 -2.00 20.00 -2.00 318.60 0.00e+00 3.051 0.000 302.00 328.00 3 4.8880e+00 1.2162e-02 3.7274e-02 -6.0000e+00 1.9283e-01 -9.1855e-03 1.4331e-02 2.1462e-02 -6.0000e+00 2.0886e-01 -8.2757e-03 1.0370e-02 1.0260e-02 -6.0000e+00 1.2468e-01 -2.0357e-03 5.3090e-03 2.8932e-03 -6.0000e+00 5.1883e-02 1.1839e-04 -5.3314e-05 2.5892e-04 3.5119e-05 -6.0000e+00 3.9699e-03 -2.1545e-03 8.3741e-05 12 9 9 12 1 1 84.51 22.18 0.27 -0.00215 -0.00256 3 4 1 5 0 2822.880 26.83 20.00 22.18 30.09 14.5 1038.54 -44802 -1561 28862 -34966 21460 -44404 -4445 -31792 4084 -51823 16149 -11251 95962 -23066 -1341 -2324 -3510 14024 3357 2116 -12603 -11563 6547 -10730 -2866 -1121 -3649 -26156 -9252 3771 3929 1475 8058 -3416 -5805 14503 -6946 1022 5560 -2159 11982 -1047 6482 -204 -1240 -2231 -600 5493 3367 2720 2859 1947 621 2023 -318 1180 931 -2117 996 -836 715 -963 4104 -297 -971 1213 -1755 609 -565 1756 278 -633 1696 -45 -590 -1572 -169 -44 124 -666 -1975 -713 -672 -1107 -1049 -489 -1296 439 646 80 846 -902 1821 328 1564 834 -196 -108 696 -1034 -1027 372 -793 229 -509 -257 -513 -449 -823 134 426 69 902 135 -854 52 1061 -753 204 -1011 -1076 -41 312 1296 732 -33 1811 1623 302 -756 197 322 -194 -94 211 -171 -35 372 200 -124 -269 -328 -737 -1529 -39 554 -1135 394 -1536 -116 -1203 121 -2702 471 -471 1751 -1484 -80 -157 -257 921 258 171 -1173 -1089 556 -1134 -304 -120 -396 -3326 -1003 379 439 188 1035 -484 -824 1795 -1180 191 1186 -557 2922 -306 1811 -62 -381 -695 -183 1586 1013 867 985 717 249 846 -142 533 427 -992 447 -387 343 -501 2216 -177 -575 670 -975 341 -352 1169 202 -466 1223 -31 -386 -945 -96 -25 77 -464 -1542 -606 -599 -1054 -1047 -516 -1412 479 694 84 834 -841 1614 302 1522 901 -231 -136 907 -1335 -1263 427 -892 265 -622 -330 -685 -625 -1210 207 689 113 1421 205 -1255 74 1500 -1139 318 -1629 -1739 -66 481 1929 1066 -47 2503 2297 460 -1234 332 555 -349 -175 407 -339 -71 752 407 -245 -519 -623 -1397 SS 20220829T120334.8Z 8276.502487 564 1 48.67 2 70.75 94.45 94.48 83.26 0.00 1 0.00 1 0 17 1.004e-01 6.716e-03 7.872e-02 5.081e-03 3.997778e-01 2.688444e-03 4.606152e-03 -6.000000e+00 6.017444e-02 230.68 -2.00 3.51 -2.00 319.92 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