File name: Pandora179s1_CornwallCT_20241105_L2Fit_fout2c40d20221201p1-8.txt File generation date: 20241106T044343.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c40p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 179 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora179_OF_v3d20220331.txt Instrument calibration file used: Pandora179s1_CF_v40d20221201.txt Level 1 file used: Pandora179s1_CornwallCT_20241105_L1_smca1c40d20221201p1-8.txt Full location name: Cornwall - Mohawk Mt CTDEEP (USEPA AQS Site ID 09-005-0005) Short location name: CornwallCT Country of location: United States Location latitude [deg]: 41.8213 Location longitude [deg]: -73.2973 Location altitude [m]: 505 Local noon date: 20241105 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: 205 347 Nominal wavelengths inside fitting window [nm]: 305.0173 305.1585 305.2997 305.4409 305.5821 305.7232 305.8644 306.0055 306.1467 306.2878 306.4289 306.5700 306.7111 306.8521 306.9932 307.1343 307.2753 307.4163 307.5573 307.6983 307.8393 307.9803 308.1213 308.2623 308.4032 308.5442 308.6851 308.8260 308.9669 309.1078 309.2487 309.3896 309.5304 309.6713 309.8121 309.9529 310.0938 310.2346 310.3754 310.5161 310.6569 310.7977 310.9384 311.0792 311.2199 311.3606 311.5013 311.6420 311.7827 311.9234 312.0640 312.2047 312.3453 312.4859 312.6265 312.7672 312.9077 313.0483 313.1889 313.3295 313.4700 313.6105 313.7511 313.8916 314.0321 314.1726 314.3131 314.4535 314.5940 314.7344 314.8749 315.0153 315.1557 315.2961 315.4365 315.5769 315.7173 315.8576 315.9980 316.1383 316.2786 316.4189 316.5592 316.6995 316.8398 316.9801 317.1203 317.2606 317.4008 317.5410 317.6812 317.8214 317.9616 318.1018 318.2420 318.3821 318.5223 318.6624 318.8025 318.9426 319.0827 319.2228 319.3629 319.5029 319.6430 319.7830 319.9231 320.0631 320.2031 320.3431 320.4831 320.6230 320.7630 320.9029 321.0429 321.1828 321.3227 321.4626 321.6025 321.7424 321.8823 322.0221 322.1620 322.3018 322.4416 322.5814 322.7212 322.8610 323.0008 323.1406 323.2803 323.4201 323.5598 323.6995 323.8392 323.9789 324.1186 324.2583 324.3980 324.5376 324.6773 324.8169 324.9565 --------------------------------------------------------------------------------------- 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 20241105T124354.9Z 9075.530497 75 1 48.48 2 78.79 123.55 120.45 103.24 0.00 1 0.00 1 0 17 2.061e-01 5.618e-03 1.523e-01 2.862e-03 5.505091e-01 1.473583e-03 6.250191e-03 -6.000000e+00 1.160645e-01 223.61 -2.00 3.52 -2.00 320.75 0.00e+00 3.162545e-03 5.984202e-04 3.825603e-04 -6.000000e+00 5.112783e-03 277.99 -2.00 20.00 -2.00 320.19 0.00e+00 4.968 0.002 302.00 328.00 3 2.1056e+00 4.5200e-03 5.4466e-02 -6.0000e+00 2.8606e-01 4.7558e-02 5.8943e-03 2.9068e-02 -6.0000e+00 3.1209e-01 -2.3784e-02 5.8736e-03 1.5243e-02 -6.0000e+00 1.8604e-01 -1.6546e-03 2.9287e-03 6.0331e-03 -6.0000e+00 7.8711e-02 3.3956e-04 -7.3954e-04 8.3179e-05 6.1482e-05 -6.0000e+00 5.6170e-03 1.3159e-02 0.0000e+00 10 0 0 10 0 0 100.00 22.75 0.43 0.01316 0.00760 268 64 1 5 0 180.880 25.90 20.00 22.75 16.29 33.9 944.43 -30055 116118 -91983 -50304 -65191 3380 -60076 -12224 -24473 25161 -98617 -69245 -67685 -37029 16719 -21989 -4152 -18326 11422 509 1997 -14545 1469 -17070 -6809 -5622 -16611 2371 -6687 2933 -7346 -994 3467 11337 -1802 -3522 -8141 -8348 2345 1351 -971 -3519 1681 -326 861 634 -3556 1315 -95 -134 2235 5474 -922 4375 333 3006 -1540 -511 487 423 394 -137 3380 1761 2744 -1833 385 319 -751 1549 586 1105 -373 858 246 -37 -782 -817 844 -426 -1553 -1097 -1373 -2317 -336 -28 707 -301 1085 -7 656 247 141 1219 39 42 72 1031 127 113 -352 -1158 -235 -437 -607 -1070 -503 -913 -346 153 179 -46 64 215 -44 525 170 331 283 -183 -239 172 195 375 36 585 -114 988 133 164 165 -370 -65 -231 -296 -176 84 449 -34 -233 9 -30 -100 -151 324 -1130 -407 -564 14 -503 -72 -184 126 -1789 -1024 -1209 -620 205 -479 -86 -481 242 13 51 -443 39 -596 -232 -201 -682 79 -237 99 -318 -48 184 604 -107 -207 -545 -659 204 143 -119 -477 229 -47 124 93 -557 201 -15 -23 406 1071 -210 1026 86 787 -395 -143 132 113 109 -42 1016 602 974 -662 132 111 -289 667 282 555 -189 409 109 -15 -319 -332 371 -202 -867 -692 -950 -1714 -260 -23 611 -270 963 -6 525 184 100 871 31 39 76 1220 164 146 -425 -1278 -237 -448 -672 -1260 -622 -1208 -453 222 283 -76 104 335 -65 733 239 487 443 -301 -392 273 299 552 56 864 -164 1465 203 279 305 -723 -133 -497 -682 -392 192 1034 -78 -518 21 -65 -211 SS 20241105T124915.5Z 9075.534207 78 1 47.15 2 77.97 124.55 119.53 103.97 0.00 1 0.00 1 0 17 5.802e-01 5.459e-02 2.186e-01 1.553e-02 5.251174e-01 8.095870e-03 6.256518e-03 -6.000000e+00 3.316196e-01 223.61 -2.00 3.52 -2.00 320.17 0.00e+00 4.776889e-03 2.485067e-03 1.219517e-03 -6.000000e+00 1.546629e-02 277.98 -2.00 20.00 -2.00 319.53 0.00e+00 4.654 0.002 302.00 328.00 3 5.2719e+00 2.2990e-02 5.1120e-02 -6.0000e+00 8.2164e-01 6.0498e-01 2.7991e-02 2.7157e-02 -6.0000e+00 9.0073e-01 -7.0693e-01 2.0935e-02 1.4897e-02 -6.0000e+00 5.3438e-01 3.1148e-01 1.0448e-02 5.5900e-03 -6.0000e+00 2.2484e-01 1.6766e-05 -4.2332e-03 4.5666e-04 6.6423e-05 -6.0000e+00 1.6257e-02 2.6398e-02 0.0000e+00 12 9 8 11 32 0 99.98 22.75 2.40 0.02640 -0.00541 13 3 1 5 0 3626.090 25.90 20.00 22.75 16.57 33.8 944.66 77708 -5341 900000 900000 224031 119943 157625 -68734 287291 900000 -120027 -52859 -2726 -4477 900000 33899 900000 88606 48336 131903 50569 900000 900000 11630 331580 90367 39116 47565 24767 -60240 14682 -15894 130349 900000 51107 71822 -13631 10547 26596 142646 17971 40793 34411 45388 -7248 30708 15161 65387 37263 10852 25573 79111 7660 23168 15775 47894 5847 -12121 19813 16789 14089 -34 8779 13335 13236 -31329 9555 -6866 -8890 4368 7037 7254 1899 -4893 -365 1350 18099 -966 -1680 -11149 -20877 -532 -1020 167 2628 8762 -423 -3490 3318 -10048 5804 -6684 2339 2059 -2187 -711 -6262 -3100 -593 -3932 -1431 -5409 799 -4423 451 3289 6165 -1649 -3808 -327 3331 -1385 -693 2279 844 760 2499 2209 639 -343 3176 -2481 2026 3370 -2284 11690 -374 1385 1477 708 665 -184 -632 -28 876 -2240 196 1393 888 810 -2710 -850 -3042 2530 -415 900000 900000 3387 2092 2383 -7994 4344 900000 -22813 -5594 -200 -401 900000 2799 900000 4740 3991 4756 4058 900000 900000 1298 5013 4729 3366 3540 2160 -12260 1554 -2588 5912 900000 4696 5429 -2314 1582 3990 8447 3762 7116 6563 7812 -2091 6036 3456 9721 6804 2638 5710 12160 2370 6494 4935 11029 2067 -5047 5761 4881 4260 -13 3328 5319 5496 -19493 3756 -3162 -4446 2164 3732 3999 1093 -2851 -186 603 6750 -393 -743 -6276 -14957 -351 -735 125 2042 6817 -379 -3316 2945 -9827 4502 -5426 1632 1441 -1742 -636 -6773 -3685 -746 -5113 -1704 -6071 774 -4532 473 3553 6804 -2092 -5333 -488 5225 -2383 -1173 3576 1256 1075 3474 3215 1004 -570 5098 -4089 3082 4868 -3334 14221 -494 1844 2172 1162 1180 -345 -1236 -54 1749 -4832 420 2993 1907 1669 -5452 -1706 -6036 SS 20241105T131152.2Z 9075.549910 87 1 1.20 2 74.59 128.94 115.65 107.06 0.00 1 0.00 1 0 17 1.316e-01 1.256e-02 1.384e-01 1.084e-02 4.202807e-01 5.379641e-03 4.993651e-03 -6.000000e+00 7.413371e-02 223.61 -2.00 3.52 -2.00 319.00 0.00e+00 2.619460e-03 1.277673e-03 5.699088e-04 -6.000000e+00 3.265249e-03 277.98 -2.00 20.00 -2.00 318.37 0.00e+00 3.696 0.001 302.00 328.00 3 2.5008e+00 1.4745e-02 4.0641e-02 -6.0000e+00 1.8271e-01 4.8601e-02 1.7051e-02 2.1450e-02 -6.0000e+00 1.9933e-01 -5.0765e-02 1.2677e-02 1.1030e-02 -6.0000e+00 1.1882e-01 1.8276e-02 6.7216e-03 3.8826e-03 -6.0000e+00 5.0284e-02 8.2916e-04 -6.7202e-04 3.0956e-04 4.0598e-05 -6.0000e+00 3.5869e-03 1.1489e-02 0.0000e+00 12 9 9 12 1 1 999.00 22.78 0.27 0.01149 0.00644 1 19 1 5 0 595.780 26.00 19.99 22.78 17.00 33.6 946.65 -4348 49569 -1487 24379 -27309 103233 -43155 8108 -33077 27058 -50738 -2737 1933 -4135 18633 767 5176 -13129 17418 -9962 15891 -5456 17314 340 3244 4089 -3913 12996 -15049 12396 -13914 -2128 -8492 4542 -3415 1873 -639 -3707 1941 560 659 -5138 2931 334 -695 519 -1341 932 -2276 3295 2041 7018 -1910 3625 -2455 -500 653 -2195 1307 696 894 -279 2527 493 4036 -2261 -554 -194 3170 1634 -814 3267 -1087 1642 -727 2610 -842 -284 -5267 453 -1117 -2623 -1468 -1677 504 -560 399 -65 1344 -469 -517 74 -369 -467 464 1248 491 -1985 441 332 -1492 -414 -352 -550 -345 -1513 -57 -818 793 -52 1465 -43 1246 -35 -55 1148 260 603 -666 1297 93 -163 -714 529 -557 -220 251 458 952 1015 580 -1821 411 -1517 6 -1272 -422 1490 555 595 -70 -387 -471 -120 927 -50 615 -1044 1091 -1895 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