File name: Pandora179s1_CornwallCT_20240506_L2Fit_fout2c40d20221201p1-8.txt File generation date: 20240511T141236.9Z 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 v1.8.59 Instrument operation file used: Pandora179_OF_v3d20220331.txt Instrument calibration file used: Pandora179s1_CF_v40d20221201.txt Level 1 file used: Pandora179s1_CornwallCT_20240506_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: 20240506 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 20240506T130422.8Z 8892.544708 178 1 48.92 2 54.01 99.87 44.57 125.62 0.00 1 0.00 1 0 17 1.284e-02 6.566e-03 3.190e-03 1.379e-03 2.553755e-01 7.018684e-04 3.053214e-03 -6.000000e+00 7.410590e-03 230.07 -2.00 3.52 -2.00 316.50 0.00e+00 2.870727e-04 8.146699e-05 4.802653e-05 -6.000000e+00 3.205643e-04 279.47 -2.00 20.00 -2.00 315.84 0.00e+00 1.697 0.000 302.00 328.00 3 4.8247e+00 1.8377e-03 2.0871e-02 -6.0000e+00 1.8531e-02 4.8805e-02 2.0557e-03 1.3175e-02 -6.0000e+00 2.0113e-02 -6.4094e-03 1.1960e-03 6.4370e-03 -6.0000e+00 1.1939e-02 -1.2961e-03 5.5974e-04 1.7902e-03 -6.0000e+00 4.9951e-03 6.1172e-04 -1.5355e-04 3.9351e-05 2.1032e-05 -6.0000e+00 3.5038e-04 7.5517e-03 0.0000e+00 11 8 0 10 0 0 99.99 22.78 0.35 0.00755 0.00640 32 8 1 5 0 1528.440 26.00 20.00 22.78 21.27 31.0 1022.42 965 1961 -1869 -2151 -4026 -2485 -3548 -2247 120 2883 -6473 -2448 -3896 -593 1435 -778 917 -351 466 869 1001 834 2811 290 1436 1196 -500 594 -1189 322 804 1821 1820 2340 -2339 -1285 -3015 -1191 289 172 -740 -938 -440 -831 -542 -1170 -1208 -665 -753 -408 728 1332 404 1473 337 1747 438 238 739 543 924 967 1796 1202 565 -1225 22 -966 708 671 325 536 84 252 -447 294 -274 -610 -468 -637 -1693 -1168 -2043 -1708 -507 -524 -263 -323 598 -42 687 104 332 711 616 479 268 930 50 -107 -163 -660 -222 119 -553 -687 -385 -843 -105 52 266 -238 88 17 94 458 192 278 44 -161 -294 234 319 400 220 750 266 1216 634 88 249 -132 133 -81 -263 -191 -15 243 -400 150 -92 -480 -556 147 330 -339 -375 -636 -359 -536 -372 22 542 -1334 -486 -862 -134 363 -223 272 -109 149 287 338 280 934 104 536 466 -199 222 -419 108 280 678 733 976 -968 -505 -1290 -537 154 100 -481 -602 -289 -555 -359 -779 -790 -449 -496 -268 494 901 292 1109 265 1381 357 194 588 428 744 783 1564 1123 533 -1092 18 -812 580 620 313 540 85 246 -434 255 -228 -481 -382 -548 -1656 -1185 -2235 -1849 -579 -610 -322 -409 752 -51 810 112 344 709 646 524 326 1184 65 -144 -205 -809 -257 141 -679 -894 -522 -1143 -149 74 400 -363 128 24 129 587 246 371 59 -234 -439 343 454 544 298 962 343 1565 832 125 350 -191 196 -118 -408 -297 -24 395 -655 238 -147 -742 -845 SS 20240506T130905.8Z 8892.547983 181 1 48.94 2 53.14 100.77 43.86 126.89 0.00 1 0.00 1 0 17 1.153e-02 6.048e-03 2.551e-03 1.129e-03 2.500408e-01 5.748690e-04 3.006609e-03 -6.000000e+00 6.655867e-03 230.07 -2.00 3.52 -2.00 316.43 0.00e+00 3.470307e-04 6.627884e-05 4.220784e-05 -6.000000e+00 2.879190e-04 279.47 -2.00 20.00 -2.00 315.78 0.00e+00 1.663 0.000 302.00 328.00 3 4.4928e+00 1.5047e-03 2.0466e-02 -6.0000e+00 1.6644e-02 4.6816e-02 1.6824e-03 1.2939e-02 -6.0000e+00 1.8064e-02 -5.6742e-03 9.7665e-04 6.3279e-03 -6.0000e+00 1.0724e-02 -2.6036e-03 4.5656e-04 1.7640e-03 -6.0000e+00 4.4863e-03 8.8902e-04 -1.2606e-04 3.2180e-05 2.0871e-05 -6.0000e+00 3.1470e-04 7.6824e-03 0.0000e+00 10 0 0 10 0 0 99.98 22.79 0.35 0.00768 0.00674 43 10 1 5 0 1137.880 26.00 20.00 22.79 21.43 31.0 1023.20 984 -4 -244 -3200 -4972 -4592 -1977 -3239 455 854 -3829 -1683 -2608 -1162 1229 28 -690 396 555 1908 1226 503 2129 569 1763 845 115 -955 -844 -17 1553 922 2112 1525 -2357 -633 -2799 -1287 -180 62 -1019 -474 -543 -634 -456 -273 -918 -468 -600 -363 728 632 828 954 585 1408 821 489 447 647 783 1007 1290 1259 194 -898 316 -752 682 668 413 185 44 305 -228 -165 -113 -665 -207 -408 -1250 -1073 -1891 -1852 -878 -668 -259 -269 314 130 480 301 332 640 617 362 362 731 -61 -173 -163 -631 -443 218 -587 -856 -528 -741 -213 410 287 -18 127 38 97 432 299 352 184 -164 -288 -19 48 405 484 913 413 1272 441 259 288 -150 -44 2 -169 -211 -80 120 -297 -211 -181 -466 -274 154 -1 -45 -578 -813 -695 -301 -555 84 167 -785 -339 -581 -291 343 9 -210 123 179 627 415 170 716 204 659 331 46 -363 -297 -6 538 346 846 640 -973 -247 -1191 -623 -95 39 -654 -317 -374 -443 -317 -189 -627 -309 -388 -233 483 450 621 753 447 1086 648 386 347 496 614 842 1166 1137 178 -822 263 -611 575 595 406 191 46 304 -213 -148 -91 -544 -174 -359 -1171 -1106 -1978 -2028 -1017 -782 -318 -342 398 159 572 328 350 649 657 400 445 934 -78 -232 -206 -779 -516 261 -723 -1118 -718 -1000 -300 579 427 -27 183 54 132 553 382 468 249 -237 -428 -27 68 548 654 1169 536 1644 578 363 402 -215 -64 3 -258 -339 -125 192 -479 -330 -287 -713 -410 SS 20240506T131737.5Z 8892.553906 187 1 5.83 2 51.58 102.44 42.60 129.25 0.00 1 0.00 1 0 17 9.239e-03 6.118e-03 1.741e-03 9.013e-04 2.400176e-01 4.612739e-04 2.897106e-03 -6.000000e+00 5.331753e-03 230.07 -2.00 3.52 -2.00 316.02 0.00e+00 1.744310e-04 4.806141e-05 4.106247e-05 -6.000000e+00 2.306455e-04 279.47 -2.00 20.00 -2.00 315.39 0.00e+00 1.606 0.000 302.00 328.00 3 2.0612e+00 1.2005e-03 1.9708e-02 -6.0000e+00 1.3333e-02 2.7988e-02 1.3395e-03 1.2407e-02 -6.0000e+00 1.4471e-02 -6.6585e-03 7.6899e-04 6.0702e-03 -6.0000e+00 8.5903e-03 -9.9562e-04 3.4978e-04 1.6775e-03 -6.0000e+00 3.5936e-03 1.0962e-02 -2.6005e-04 2.5650e-05 2.0493e-05 -6.0000e+00 2.5211e-04 8.0890e-03 0.0000e+00 12 1 1 12 1 1 99.66 22.80 0.33 0.00809 0.00613 46 94 1 5 0 123.980 26.00 20.00 22.80 21.86 31.0 1026.04 -163 -1073 -1241 -2970 -3195 -3395 -730 -1153 846 -490 -1932 -1912 -578 -897 -86 498 -674 1231 402 1663 597 514 931 1008 656 918 610 -767 151 597 1869 1031 2208 430 -2094 -1429 -2036 -1049 -30 -69 -1055 -511 -708 -606 -356 -343 -805 -378 -573 -353 940 667 896 1076 759 553 693 388 367 394 883 1221 1443 1372 66 -355 -147 -371 665 715 234 76 -35 151 14 -217 41 -550 230 -506 -1088 -1273 -2078 -1627 -1101 -918 -415 -387 110 72 297 399 310 838 774 444 693 531 113 -382 -173 -674 -83 165 -603 -877 -558 -629 -385 328 15 151 169 84 292 408 541 413 429 -168 -428 79 224 313 468 697 629 1309 523 364 127 -216 -205 157 -212 -332 -117 115 -337 -254 -40 -395 -351 -33 -240 -287 -669 -640 -633 -137 -241 194 -121 -484 -479 -156 -253 -27 174 -250 462 158 615 229 195 356 404 278 403 270 -326 59 242 777 429 977 202 -952 -619 -948 -518 -18 -44 -708 -357 -510 -442 -258 -248 -572 -259 -410 -251 645 491 695 876 603 448 571 320 297 315 721 1061 1281 1298 63 -316 -127 -311 579 663 227 77 -36 149 14 -202 34 -462 198 -461 -1057 -1295 -2277 -1766 -1270 -1080 -513 -494 140 89 355 432 323 880 809 486 840 679 147 -491 -218 -825 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