File name: Pandora64s1_NewHavenCT_20240221_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240222T051143.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240221_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20240221 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 20240221T122039.6Z 8817.514347 253 1 47.23 2 83.30 110.52 105.02 323.66 0.00 1 0.00 1 0 25 8.906e-01 8.637e-02 3.865e-01 3.297e-02 1.118058e+00 1.993279e-02 1.271225e-02 -6.000000e+00 5.333166e-01 225.14 -2.00 3.52 -2.00 321.67 0.00e+00 -7.367809e-03 6.454800e-03 8.083015e-03 -6.000000e+00 2.417919e-02 275.37 -2.00 20.00 -2.00 321.11 0.00e+00 7.813 0.009 302.00 328.00 3 2.0390e+00 6.1863e-02 1.0875e-01 -6.0000e+00 1.3212e+00 2.4327e+00 7.1362e-02 8.7319e-02 -6.0000e+00 1.4340e+00 -2.4818e+00 4.2827e-02 3.1441e-02 -6.0000e+00 8.5039e-01 8.3727e-01 2.3601e-02 1.2248e-02 -6.0000e+00 3.6178e-01 5.8422e-06 -1.2394e-03 8.2964e-04 1.3376e-04 -6.0000e+00 2.6645e-02 3.3485e-03 -1.3620e-04 12 9 8 11 8 0 91.73 21.66 -0.15 0.00335 -0.00596 12 3 1 5 0 3935.780 26.11 20.00 21.66 1.43 36.0 921.45 89106 356069 68586 135111 -8646 165161 -29172 158648 181424 900000 -13559 135069 -8926 39649 66725 46400 32505 169153 22910 178570 99960 900000 900000 285234 25239 208321 80347 -934 7986 -122673 12676 44566 217378 88357 60159 288367 107580 -364 116763 4219 172890 64685 129028 -52106 44630 -23768 237133 -790 -42252 33865 290878 96524 900000 4741 69546 -21186 204012 17244 219716 -485 66474 43827 61068 15226 103932 63879 63694 130697 32241 43572 62042 35108 10107 -17800 1076 -15933 91652 17464 -27836 25001 2194 -9671 14623 28607 11039 -5688 15132 19703 18612 15497 -26832 37937 -5892 14534 -7283 22022 -6160 1885 3223 -288 -14734 -1310 -28033 6117 -13085 -9910 -8932 53521 -5002 11910 5147 2620 -3011 9455 -4328 -1070 -1908 -561 -5416 1855 -5699 9721 178 6759 8998 -1817 -3272 8468 -405 -4266 -1417 -4993 -584 184 2960 308 715 841 5415 -2660 -297 -3062 9339 11436 7188 6382 -1194 5305 -4544 5096 5827 900000 -1902 5694 -1539 4759 7144 6040 4835 7470 3408 6500 6232 900000 900000 9161 2972 6691 4858 -105 784 -43932 1515 4215 6982 5676 4546 9262 5615 -57 7266 749 7404 6694 7511 -14357 4891 -4420 7616 -125 -10071 4290 9343 8206 900000 1010 8314 -5981 7426 3108 7057 -87 6531 5879 7730 3179 9622 8810 8751 11019 7249 9563 11624 8394 2682 -5506 251 -3980 8831 3459 -9787 6513 790 -4463 5661 10059 4833 -2859 6574 8027 7362 5894 -14650 11305 -2709 6216 -4375 12285 -5035 1616 2852 -254 -13700 -932 -23950 3811 -10402 -7957 -7718 29042 -5382 12624 6620 3518 -4389 12663 -6189 -1471 -2732 -821 -8574 2670 -8315 11990 234 8043 10289 -2279 -4283 11396 -676 -8546 -3113 -12403 -1507 485 8120 888 2064 2421 14302 -7026 -738 -7291 SS 20240221T123037.4Z 8817.521266 256 1 48.37 2 81.55 112.25 106.08 325.63 0.00 1 0.00 1 0 17 4.473e-01 2.631e-02 1.255e-01 3.649e-03 1.031323e+00 2.127625e-03 1.144307e-02 -6.000000e+00 2.674415e-01 225.14 -2.00 3.52 -2.00 321.97 0.00e+00 2.390316e-02 1.134391e-03 5.020483e-03 -6.000000e+00 1.156685e-02 275.37 -2.00 20.00 -2.00 321.57 0.00e+00 6.410 0.005 302.00 328.00 3 5.8203e-01 7.5582e-03 9.7839e-02 -6.0000e+00 6.6186e-01 1.1114e+00 1.0230e-02 9.2962e-02 -6.0000e+00 7.1811e-01 -1.4655e+00 9.9635e-03 3.0034e-02 -6.0000e+00 4.2675e-01 6.0411e-01 4.6711e-03 2.6171e-02 -6.0000e+00 1.8096e-01 1.4319e-04 -2.6689e-03 9.2515e-05 3.2088e-04 -6.0000e+00 1.3286e-02 1.4522e-03 -1.0561e-04 12 9 8 11 8 0 39.50 21.68 0.18 0.00145 -0.01860 130 31 1 5 0 372.010 26.11 20.00 21.68 1.94 35.9 923.66 -101853 -7815 -55231 -38659 -250865 -102321 -141522 -127662 -113783 -105550 -139259 6412 -73707 -83393 -1823 33806 -733 64678 25364 35753 17414 55950 41935 -8473 -30351 -35229 -21969 -57678 -12287 -63036 20222 24318 50402 37774 50960 15883 34526 9261 57628 22007 63569 39463 83083 18501 53203 34854 68770 40961 46386 17423 62428 42873 77708 42336 51411 24913 32950 26397 42304 16021 26243 24903 32386 27679 35719 19468 22059 19145 22974 17918 17150 15272 9758 7316 4026 363 4446 -2692 60 5531 1576 -1132 209 140 -478 -660 385 2540 1152 1512 -2742 -1666 -6781 -4435 -5086 -2397 -3999 -375 -17 55 -1349 -2227 -5075 -1085 -2896 -3820 -3656 -2412 -2875 -1047 -641 -1078 -989 -779 -1290 -1132 192 392 1725 2405 1952 2129 2897 2508 3392 2100 -953 955 1755 1105 1275 125 -81 -387 752 -295 -278 342 354 -767 -526 -2793 -2009 -72 -750 -426 -16287 -1602 -2700 -2180 -1619 -1352 -2626 36 -1337 -2104 -29 457 -16 782 460 572 310 617 507 -160 -669 -790 -422 -1601 -240 -2344 475 657 1201 1021 1106 486 933 359 1558 939 1900 1572 2246 886 2044 1686 2520 2157 2508 1262 3251 2981 4506 3368 3758 2361 2813 2288 2996 1482 2351 2593 3655 3760 4725 3073 3588 3418 4451 3734 3762 3396 2141 1486 818 70 841 -563 15 1592 555 -470 92 65 -237 -340 203 1313 593 735 -1311 -774 -3434 -2488 -3183 -1761 -3536 -370 -18 56 -1290 -1887 -4047 -847 -2438 -3393 -3530 -2557 -3288 -1368 -944 -1701 -1592 -1238 -2009 -1749 303 602 2714 3718 3077 3154 4114 3449 4524 2793 -1328 1487 3001 2187 2651 284 -200 -1024 1970 -800 -756 923 925 -1994 -1258 -6346 SS 20240221T124524.5Z 8817.531534 261 1 48.40 2 79.00 114.88 107.56 328.61 0.00 1 0.00 1 0 17 7.478e-01 1.157e-02 5.824e-02 1.246e-03 8.579771e-01 7.071981e-04 9.620560e-03 -6.000000e+00 4.473184e-01 225.14 -2.00 3.52 -2.00 321.30 0.00e+00 4.292732e-03 3.384084e-04 2.363560e-03 -6.000000e+00 1.934007e-02 275.37 -2.00 20.00 -2.00 320.86 0.00e+00 5.057 0.002 302.00 328.00 3 4.4734e-01 2.3161e-03 6.8414e-02 -6.0000e+00 1.1070e+00 1.5081e-01 3.4005e-03 4.7588e-02 -6.0000e+00 1.2009e+00 -1.8702e-01 3.7992e-03 2.8437e-02 -6.0000e+00 7.1368e-01 6.9785e-02 1.7906e-03 1.1247e-02 -6.0000e+00 3.0276e-01 8.6150e-04 -7.0953e-04 3.3419e-05 1.5298e-04 -6.0000e+00 2.2218e-02 -2.8832e-05 -5.9655e-05 12 9 8 11 8 0 12.87 21.72 0.22 -0.00003 -0.00536 383 92 1 5 0 126.350 26.11 20.00 21.72 2.70 36.1 927.40 -246316 -256627 -219592 -272404 -324703 -261020 -177232 -237209 -194664 -212913 -164795 -186315 -125760 -134675 -85865 -97751 -52057 -76219 -56501 -65342 -60318 -68821 -46781 -59306 -42442 -62286 -47891 -54114 -45755 -52555 -22598 -17343 -10563 -13027 -20353 -15333 -12106 -7557 -1881 3212 1989 1179 3470 1142 3405 7261 3830 6837 5466 3949 7829 11178 8609 10348 5650 6647 4307 4182 3914 4425 3603 5904 6509 8301 4066 3028 2469 1901 2981 3960 2283 2912 593 1256 -1007 -1787 -1676 -2322 -1361 -319 -1273 -613 -1615 -1731 -1054 -559 302 303 1183 308 -33 -620 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