File name: Pandora69s1_NewBrunswickNJ_20231215_L2Fit_fout2c23d20210421p1-8.txt File generation date: 20240123T190848.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c23p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 69 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora69_OF_v2d20210223.txt Instrument calibration file used: Pandora69s1_CF_v23d20210421.txt Level 1 file used: Pandora69s1_NewBrunswickNJ_20231215_L1_smca1c23d20210421p1-8.txt Full location name: Rutgers NJDEP (USEPA AQS ID 34-023-0011) Short location name: NewBrunswickNJ Country of location: USA Location latitude [deg]: 40.4622 Location longitude [deg]: -74.4294 Location altitude [m]: 19 Local noon date: 20231215 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: based on s13, field cal for NewBrunswick, revisited HCHO First and last pixel inside fitting window: 259 400 Nominal wavelengths inside fitting window [nm]: 305.1248 305.2657 305.4066 305.5475 305.6883 305.8292 305.9700 306.1109 306.2517 306.3925 306.5333 306.6741 306.8148 306.9556 307.0963 307.2371 307.3778 307.5185 307.6592 307.7999 307.9406 308.0812 308.2219 308.3625 308.5032 308.6438 308.7844 308.9250 309.0656 309.2062 309.3467 309.4873 309.6278 309.7683 309.9089 310.0494 310.1898 310.3303 310.4708 310.6113 310.7517 310.8921 311.0326 311.1730 311.3134 311.4537 311.5941 311.7345 311.8748 312.0152 312.1555 312.2958 312.4361 312.5764 312.7167 312.8570 312.9972 313.1375 313.2777 313.4179 313.5581 313.6983 313.8385 313.9787 314.1189 314.2590 314.3991 314.5393 314.6794 314.8195 314.9596 315.0997 315.2397 315.3798 315.5198 315.6599 315.7999 315.9399 316.0799 316.2199 316.3598 316.4998 316.6397 316.7797 316.9196 317.0595 317.1994 317.3393 317.4792 317.6190 317.7589 317.8987 318.0386 318.1784 318.3182 318.4580 318.5978 318.7375 318.8773 319.0170 319.1568 319.2965 319.4362 319.5759 319.7156 319.8552 319.9949 320.1345 320.2742 320.4138 320.5534 320.6930 320.8326 320.9722 321.1117 321.2513 321.3908 321.5303 321.6698 321.8093 321.9488 322.0883 322.2278 322.3672 322.5067 322.6461 322.7855 322.9249 323.0643 323.2037 323.3430 323.4824 323.6217 323.7611 323.9004 324.0397 324.1790 324.3183 324.4575 324.5968 324.7360 324.8753 --------------------------------------------------------------------------------------- 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 20231215T125021.8Z 8749.534975 56 1 50.87 2 85.02 126.55 113.07 105.57 0.00 1 0.00 1 0 25 4.874e-01 5.865e-02 5.288e-01 5.802e-02 9.143444e-01 3.536191e-02 9.942255e-03 -6.000000e+00 2.940341e-01 222.88 -2.00 3.50 -2.00 322.13 0.00e+00 -4.738334e-03 1.216306e-02 8.918094e-04 -6.000000e+00 1.308570e-02 277.52 -2.00 20.00 -2.00 321.75 0.00e+00 9.864 0.017 302.00 328.00 3 -1.8808e-01 1.0871e-01 1.0923e-01 -6.0000e+00 7.3161e-01 1.7771e+00 1.2736e-01 4.6019e-02 -6.0000e+00 8.0812e-01 -1.9151e+00 9.7947e-02 2.4806e-02 -6.0000e+00 4.7174e-01 6.9785e-01 5.5352e-02 8.5796e-03 -6.0000e+00 1.9658e-01 1.2642e-05 -4.8835e-04 1.7746e-03 1.1400e-04 -6.0000e+00 1.4679e-02 2.1258e-02 1.5599e-04 12 8 8 10 0 0 -25.14 22.43 2.00 0.02126 0.01759 16 3 1 5 0 3178.740 25.68 20.00 22.43 6.51 28.0 913.49 197558 900000 -48020 900000 -51447 900000 140434 -17034 -33356 -76413 -81504 30001 900000 143996 104512 900000 900000 42572 900000 -15680 113221 137023 56026 900000 24303 43081 900000 900000 -47147 -36409 8777 900000 900000 -81136 900000 110056 -25706 23864 39893 59585 900000 900000 900000 86797 -23566 107847 125324 11304 113905 52773 62611 -24660 31201 13556 57024 -7785 69539 -34529 -31355 900000 22478 9103 90822 7464 -23540 42530 67145 14293 40054 -15059 51279 -14043 46163 3337 25203 -17275 22643 55769 -3885 -29281 17541 -7984 3641 -23752 11821 20321 27181 4691 20513 -10483 19098 -6069 30036 20396 15065 8710 2599 8394 6051 -12223 -10530 1650 22066 -15933 -10540 2948 -7518 1206 1853 -9879 -1550 6864 1015 2941 -2116 -7518 -1296 -724 3145 9222 3533 2074 -9206 6992 11548 -3805 2185 2105 -50 -2516 -1729 883 -215 -1207 831 3205 580 -620 -1705 -409 -898 551 11137 900000 -4922 900000 -3691 900000 7916 -960 -2051 -7049 -7936 1691 900000 8117 5891 900000 900000 2400 900000 -1286 6382 7724 3158 900000 1370 2429 900000 900000 -3624 -2799 495 900000 900000 -12474 900000 6204 -2240 1468 2453 3359 900000 900000 900000 4893 -2778 6079 7065 927 6421 3570 4235 -3918 3342 1667 5143 -1237 5488 -6547 -5303 900000 2408 1232 6144 1262 -5441 5035 6435 2498 6096 -4414 8094 -4196 7026 696 3694 -3506 3063 5973 -898 -10399 4548 -3015 1314 -11917 4398 7217 9193 1983 7169 -4669 5921 -2361 8466 7129 6539 4763 1773 6104 4673 -10887 -8429 1042 10698 -11766 -7843 2027 -6230 1020 1786 -12363 -1992 8551 1350 3747 -2743 -10255 -1724 -1008 4379 12009 4661 2654 -12766 7961 12239 -4612 2574 2824 -80 -4709 -3567 1921 -507 -3101 2229 8654 1631 -1769 -4730 -1043 -2136 1220 SS 20231215T130308.0Z 8749.543843 59 1 49.49 2 83.10 128.77 110.83 107.28 0.00 1 0.00 1 0 17 4.886e-01 1.809e-02 3.608e-01 1.080e-02 8.543513e-01 6.244633e-03 9.070528e-03 -6.000000e+00 2.811527e-01 222.88 -2.00 3.50 -2.00 322.13 0.00e+00 6.502884e-03 2.819296e-03 1.299177e-03 -6.000000e+00 1.167441e-02 277.52 -2.00 20.00 -2.00 321.78 0.00e+00 7.625 0.008 302.00 328.00 3 -1.0989e-01 2.0611e-02 8.8389e-02 -6.0000e+00 6.9615e-01 7.7816e-01 2.9315e-02 4.6302e-02 -6.0000e+00 7.6080e-01 -9.7549e-01 3.3085e-02 2.7038e-02 -6.0000e+00 4.4875e-01 3.8810e-01 1.6193e-02 9.7396e-03 -6.0000e+00 1.8989e-01 1.2826e-04 -6.3725e-04 3.3434e-04 1.4083e-04 -6.0000e+00 1.4012e-02 2.2579e-02 3.8994e-05 12 8 8 10 0 0 35.29 22.45 0.58 0.02258 0.01779 70 14 1 5 0 706.830 25.68 20.00 22.45 7.17 28.0 918.44 -102433 -46694 -49470 -84938 -85324 -203952 -3031 -177417 -138557 -73381 -150759 -101005 -162572 90423 -118859 900000 -69808 50045 -39107 171956 -6085 -57858 900000 -31324 19943 -45050 900000 -49023 103409 -41965 -7649 74260 -7107 62829 -31410 43900 -49446 34216 24535 27394 3899 1589 41376 36911 52655 75251 39457 49627 20834 22061 33808 33631 7971 47570 22787 47735 11003 30965 10430 25514 25249 2790 21610 6633 27301 4641 9885 4598 13690 11776 6195 14312 4376 5625 -1265 1990 -7577 -2857 703 -1605 -144 -4158 -338 -206 -238 -1532 4344 -2105 1928 -324 -5213 -4020 -3090 -1306 -4405 -2664 525 -306 -1149 -325 -1398 -1052 -1348 -1575 -1510 -2183 663 -1704 -65 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3.852e-03 7.515689e-01 2.116906e-03 8.141532e-03 -6.000000e+00 2.924183e-01 222.88 -2.00 3.50 -2.00 321.72 0.00e+00 4.276011e-03 9.014414e-04 9.822532e-04 -6.000000e+00 1.192437e-02 277.52 -2.00 20.00 -2.00 321.38 0.00e+00 6.365 0.005 302.00 328.00 3 -2.0617e-01 6.6955e-03 7.4582e-02 -6.0000e+00 7.2392e-01 2.7658e-01 9.9469e-03 4.0809e-02 -6.0000e+00 7.9008e-01 -3.1791e-01 1.2017e-02 2.3937e-02 -6.0000e+00 4.6606e-01 1.2148e-01 5.8559e-03 8.4684e-03 -6.0000e+00 1.9799e-01 5.5172e-04 -4.3001e-04 1.1752e-04 1.1447e-04 -6.0000e+00 1.4446e-02 2.2064e-02 9.0356e-06 12 8 8 10 0 0 23.68 22.45 0.30 0.02206 0.01883 169 35 1 5 0 295.190 25.68 20.00 22.45 7.93 27.9 923.03 -33139 -192133 -158438 -112688 -256821 -44599 -212296 60076 -196421 -113909 -177904 -69403 -88772 -124465 77482 -107115 -30096 -49853 11663 -65133 -8727 -52792 -28940 -7857 -46166 17955 -81379 11756 -66965 13798 -9250 12472 24497 -29993 22453 -31468 11116 -24828 15277 -10913 11692 5759 9292 7307 2705 5887 -5265 14005 410 16771 6305 11569 11654 4809 10867 3666 11956 1633 7374 -858 4946 5166 7281 7930 4271 7970 -378 4012 354 6716 2732 3250 4173 356 4416 -2069 2031 -4274 2956 -2186 1276 -1826 -2116 -306 -1097 598 -984 1235 179 1413 -385 -1024 -200 -1671 -569 -2015 413 -578 68 -379 -344 -279 -648 -809 -2435 -891 -2006 -258 -1261 201 -342 123 118 -648 7 -96 729 81 584 -350 766 831 502 933 430 484 741 1123 -92 596 -63 119 206 57 -165 -351 493 -309 -159 -343 -224 -226 -124 -2165 -1298 -539 -4911 -168 -2972 226 -2884 -778 -2551 -427 -879 -2295 291 -2451 -360 -800 108 -1334 -101 -973 -455 -107 -977 208 -2529 140 -1875 207 -215 277 544 -1147 491 -1257 334 -1181 647 -639 597 332 538 439 174 380 -396 921 33 1286 608 1173 1299 620 1381 517 1564 231 956 -122 718 852 1354 1608 909 1631 -87 957 92 1853 834 992 1203 98 1132 -521 490 -1209 925 -792 520 -862 -1075 -163 -629 354 -613 760 109 798 -207 -534 -105 -989 -388 -1633 381 -603 73 -390 -325 -237 -526 -691 -2247 -855 -2095 -291 -1614 286 -534 198 188 -995 10 -138 1083 127 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