File name: Pandora38s1_BayonneNJ_20231027_L2Fit_fout2c5d20230101p1-8.txt File generation date: 20231030T221221.3Z 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: 38 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora38_OF_v4d20201028.txt Instrument calibration file used: Pandora38s1_CF_v5d20230101.txt Level 1 file used: Pandora38s1_BayonneNJ_20231027_L1_smca1c5d20230101p1-8.txt Full location name: Bayonne NJDEP (USEPA AQS ID 34-017-0006) Short location name: BayonneNJ Country of location: USA Location latitude [deg]: 40.6703 Location longitude [deg]: -74.1261 Location altitude [m]: 3 Local noon date: 20231027 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: None First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.1040 305.2447 305.3854 305.5261 305.6667 305.8074 305.9480 306.0886 306.2292 306.3698 306.5104 306.6510 306.7916 306.9321 307.0727 307.2132 307.3537 307.4942 307.6347 307.7752 307.9157 308.0561 308.1966 308.3370 308.4775 308.6179 308.7583 308.8987 309.0391 309.1794 309.3198 309.4601 309.6005 309.7408 309.8811 310.0214 310.1617 310.3020 310.4423 310.5825 310.7228 310.8630 311.0032 311.1434 311.2836 311.4238 311.5640 311.7042 311.8443 311.9844 312.1246 312.2647 312.4048 312.5449 312.6850 312.8250 312.9651 313.1052 313.2452 313.3852 313.5252 313.6652 313.8052 313.9452 314.0852 314.2251 314.3651 314.5050 314.6449 314.7848 314.9247 315.0646 315.2045 315.3443 315.4842 315.6240 315.7639 315.9037 316.0435 316.1833 316.3231 316.4628 316.6026 316.7423 316.8821 317.0218 317.1615 317.3012 317.4409 317.5806 317.7202 317.8599 317.9995 318.1391 318.2788 318.4184 318.5580 318.6975 318.8371 318.9767 319.1162 319.2558 319.3953 319.5348 319.6743 319.8138 319.9533 320.0927 320.2322 320.3716 320.5110 320.6505 320.7899 320.9293 321.0686 321.2080 321.3474 321.4867 321.6261 321.7654 321.9047 322.0440 322.1833 322.3226 322.4618 322.6011 322.7403 322.8795 323.0188 323.1580 323.2972 323.4363 323.5755 323.7147 323.8538 323.9930 324.1321 324.2712 324.4103 324.5494 324.6884 324.8275 324.9666 --------------------------------------------------------------------------------------- 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 20231027T130549.9Z 8700.545716 274 1 48.80 2 72.90 124.75 123.15 314.27 0.00 1 0.00 1 0 25 4.754e-02 5.799e-03 4.118e-02 3.872e-03 3.629587e-01 1.993230e-03 4.267167e-03 -6.000000e+00 2.762211e-02 224.95 -2.00 3.51 -2.00 319.54 0.00e+00 3.746968e-04 5.524812e-04 1.882166e-04 -6.000000e+00 1.239965e-03 283.05 -2.00 20.00 -2.00 318.81 0.00e+00 3.351 0.001 302.00 328.00 3 4.1132e+00 5.6757e-03 3.8150e-02 -6.0000e+00 6.8112e-02 8.5461e-03 6.6583e-03 1.8773e-02 -6.0000e+00 7.4111e-02 -1.8055e-03 4.9751e-03 9.2702e-03 -6.0000e+00 4.4271e-02 -4.3304e-03 2.5763e-03 2.6690e-03 -6.0000e+00 1.8683e-02 2.0606e-04 -6.0904e-04 1.2434e-04 3.3287e-05 -6.0000e+00 1.4017e-03 -2.3501e-04 -5.4531e-05 10 0 0 10 0 0 99.80 21.83 0.21 -0.00024 -0.00481 43 10 1 5 0 1134.640 26.94 20.00 21.83 24.23 35.1 1009.09 -29322 -6502 -21899 16 -21145 3589 756 -13103 11773 -19873 946 -12012 -3695 -3596 4613 5986 459 7200 -1916 -641 -4921 -1787 -1614 2575 -14 -119 2628 -4188 3481 1834 5084 5816 2237 950 414 -2380 -2933 587 -4016 -988 -1568 -1118 -350 -382 -1429 109 828 -2143 57 772 1281 349 -1698 1953 -397 575 631 120 1195 1054 1810 767 1756 674 1310 121 -267 1798 504 1164 415 490 47 -356 -553 423 11 -1141 -915 -991 -281 -1493 -1408 -2053 -835 -457 -572 -243 129 7 938 740 716 1812 905 529 1051 620 239 -15 -971 -488 -76 -552 -550 -757 -799 -274 -103 202 460 -387 112 -43 619 41 391 178 -215 -283 -323 -289 -359 290 268 362 1204 672 480 251 151 -531 -101 -214 110 -185 279 -64 -10 -50 -405 21 -13 -987 -190 -758 0 -632 91 20 -445 345 -838 33 -525 -173 -199 273 388 34 523 -160 -55 -449 -160 -150 246 -2 -13 274 -445 332 183 539 681 295 129 54 -327 -452 104 -892 -246 -430 -321 -103 -114 -433 32 245 -649 17 237 421 125 -667 783 -169 250 279 53 514 455 810 377 935 386 743 66 -139 929 288 742 289 353 34 -244 -351 240 6 -603 -521 -642 -205 -1218 -1232 -1917 -824 -479 -632 -253 144 8 926 675 615 1545 840 551 1223 739 301 -19 -1139 -569 -85 -637 -681 -995 -1019 -367 -147 310 746 -643 181 -66 867 56 571 252 -325 -450 -519 -456 -551 425 407 526 1676 964 744 389 249 -916 -178 -398 216 -383 591 -138 -21 -104 -820 41 -26 SS 20231027T131018.2Z 8700.548822 277 1 15.69 2 72.21 125.63 123.71 315.36 0.00 1 0.00 1 0 17 3.307e-02 5.206e-03 2.424e-02 3.181e-03 3.500639e-01 1.626675e-03 4.158344e-03 -6.000000e+00 1.921621e-02 224.95 -2.00 3.51 -2.00 318.97 0.00e+00 8.861665e-04 3.817871e-04 1.287253e-04 -6.000000e+00 8.623638e-04 283.05 -2.00 20.00 -2.00 318.23 0.00e+00 3.228 0.001 302.00 328.00 3 3.4061e+00 4.4899e-03 3.6773e-02 -6.0000e+00 4.7385e-02 1.5592e-03 5.1808e-03 1.8132e-02 -6.0000e+00 5.1555e-02 -3.5992e-03 3.6289e-03 8.9076e-03 -6.0000e+00 3.0797e-02 -3.9644e-03 1.8832e-03 2.6581e-03 -6.0000e+00 1.3000e-02 4.7990e-04 -2.9999e-04 9.9793e-05 3.2160e-05 -6.0000e+00 9.7485e-04 -4.9928e-04 -9.0942e-06 12 1 1 12 1 1 99.46 21.82 0.21 -0.00050 -0.00275 24 18 1 5 0 627.420 26.94 19.98 21.82 24.43 35.1 1010.32 -10707 -11175 1451 -10064 -4166 -17794 -3642 -13422 4460 -10333 -9392 -5743 -11907 3886 -6229 5402 -2284 4575 415 -1153 10 3619 2164 -2300 1884 -626 -996 96 -3613 199 701 2944 -3301 309 -1133 -408 -919 -2475 -673 125 -274 -602 614 -589 -175 700 -1591 271 -1438 542 711 1545 901 1070 1605 531 1186 -287 199 88 233 1304 1888 1170 668 -393 -488 -38 617 811 520 -398 738 -202 460 -230 -254 -754 -734 -636 -1338 -1245 -1818 -1120 -803 -736 -24 114 -3 -502 654 98 146 839 909 997 925 391 -14 -74 -371 -265 270 -750 -247 -691 -759 -535 684 -119 217 -177 -5 106 141 225 231 351 -27 -456 -223 -279 -39 529 497 437 867 386 312 197 241 -188 -126 14 -177 -175 199 -52 -231 31 -435 -6 82 -411 -470 60 -397 -158 -767 -148 -679 208 -583 -490 -346 -806 265 -545 466 -227 450 45 -131 1 402 254 -301 251 -88 -139 13 -479 26 100 457 -591 54 -194 -70 -177 -576 -184 39 -94 -218 227 -223 -66 264 -610 101 -550 210 296 689 432 497 769 265 596 -145 99 44 121 730 1148 761 434 -244 -290 -23 398 587 409 -327 594 -157 327 -149 -152 -448 -471 -463 -1108 -1051 -1655 -1073 -821 -802 -27 133 -3 -560 671 93 130 746 870 1065 1108 483 -18 -95 -446 -317 307 -894 -314 -868 -1003 -744 1004 -189 340 -283 -8 165 204 310 320 509 -41 -747 -368 -454 -61 799 716 602 1151 527 460 313 407 -308 -214 25 -333 -346 376 -100 -448 62 -844 -12 150 SS 20231027T133141.6Z 8700.563677 290 1 48.50 2 69.01 130.00 126.22 320.77 0.00 1 0.00 1 0 17 3.945e-02 7.021e-03 2.936e-02 4.324e-03 3.043593e-01 2.185938e-03 3.656141e-03 -6.000000e+00 2.292181e-02 224.94 -2.00 3.51 -2.00 318.98 0.00e+00 2.048830e-04 5.064279e-04 2.456911e-04 -6.000000e+00 1.028875e-03 283.05 -2.00 20.00 -2.00 318.22 0.00e+00 2.765 0.000 302.00 328.00 3 4.8784e+00 6.0292e-03 3.1646e-02 -6.0000e+00 5.6522e-02 2.8460e-03 6.9662e-03 1.5846e-02 -6.0000e+00 6.1499e-02 9.2439e-03 4.7446e-03 7.7463e-03 -6.0000e+00 3.6738e-02 -7.9541e-03 2.4485e-03 2.1904e-03 -6.0000e+00 1.5504e-02 1.8214e-04 -2.3616e-04 1.3833e-04 2.8083e-05 -6.0000e+00 1.1631e-03 1.5032e-05 -3.1903e-05 11 8 0 10 0 0 99.75 21.77 0.20 0.00002 -0.00176 39 9 1 5 0 1243.460 26.83 20.00 21.77 25.31 34.9 1014.59 -10717 21322 -22877 -1701 -14391 12175 -6973 3603 -2869 -8138 -765 -13937 2448 -1812 -114 591 3139 2039 -4908 8324 -3175 2967 236 2843 -207 -891 3944 -3328 2233 -3070 3408 20 1930 498 -4544 2652 -3407 -126 -4081 -571 -31 266 -233 -984 1549 -1082 1189 -1731 240 -136 361 1922 272 666 -1874 1243 -1387 1229 845 763 911 1397 2661 375 1337 -1249 -50 621 832 1138 -1149 873 -451 1288 -295 272 -961 -1186 457 -947 -40 -2593 -1251 -895 -743 -208 -921 624 -160 654 86 1108 116 781 1541 526 1604 290 109 -630 -383 -429 -211 -1 -1161 -472 -883 -410 -234 239 207 -232 611 -760 438 286 -112 -51 345 -393 -597 -180 -654 399 360 1234 1246 754 842 -167 526 -247 432 -255 -91 -95 267 28 -407 230 -243 -93 -443 -539 839 -1407 -79 -698 449 -338 177 -165 -515 -46 -1019 174 -156 -11 62 340 234 -631 971 -422 373 32 396 -31 -140 582 -501 304 -448 503 3 341 90 -827 456 -692 -29 -1179 -183 -11 96 -87 -375 576 -412 437 -645 87 -51 144 811 124 319 -951 628 -729 625 425 386 480 792 1617 246 856 -769 -29 357 519 792 -885 682 -354 949 -204 169 -557 -675 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