File name: Pandora64s1_NewHavenCT_20240327_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240328T050030.9Z 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_20240327_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: 20240327 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 20240327T133643.7Z 8852.567172 325 1 48.18 2 58.95 116.71 112.68 270.72 0.00 1 0.00 1 0 25 1.467e-02 8.180e-03 1.842e-03 7.897e-04 2.595906e-01 4.211676e-04 3.136955e-03 -6.000000e+00 8.847065e-03 227.14 -2.00 3.52 -2.00 316.56 0.00e+00 5.405578e-04 5.007113e-05 7.082355e-05 -6.000000e+00 3.838963e-04 278.18 -2.00 20.00 -2.00 315.94 0.00e+00 1.931 0.000 302.00 328.00 3 3.5798e+00 1.0951e-03 2.3474e-02 -6.0000e+00 2.1975e-02 3.4336e-02 1.2217e-03 1.3310e-02 -6.0000e+00 2.3787e-02 -1.6613e-03 7.1414e-04 6.5532e-03 -6.0000e+00 1.4138e-02 -3.4834e-03 3.3592e-04 1.8861e-03 -6.0000e+00 5.9932e-03 1.5508e-03 8.0565e-05 2.4410e-05 2.3464e-05 -6.0000e+00 4.3606e-04 -2.7308e-03 5.0127e-05 11 9 0 11 8 0 99.80 21.47 0.10 -0.00273 -0.00213 103 25 1 5 0 467.670 25.90 20.00 21.47 13.39 37.7 980.61 859 -1320 1001 -3961 -10819 -1627 -235 526 544 251 -4139 -1686 -415 -20 986 556 -1041 1921 473 2397 1004 358 754 1728 121 1220 45 -728 -1052 -88 1581 461 1877 213 -4961 -2102 -1803 -1080 -32 463 -1170 -1141 -114 -910 -473 238 -651 -104 -751 -398 1262 1087 814 1453 157 671 1127 439 248 291 599 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-558 -246 -1274 SS 20240327T134657.7Z 8852.574279 328 1 48.26 2 57.25 118.96 114.56 272.35 0.00 1 0.00 1 0 17 1.514e-02 8.294e-03 2.149e-03 9.320e-04 2.484129e-01 4.981263e-04 3.007710e-03 -6.000000e+00 9.132230e-03 227.14 -2.00 3.52 -2.00 316.53 0.00e+00 5.674323e-04 5.896802e-05 8.404072e-05 -6.000000e+00 3.962485e-04 278.18 -2.00 20.00 -2.00 315.92 0.00e+00 1.842 0.000 302.00 328.00 3 3.9624e+00 1.2947e-03 2.2422e-02 -6.0000e+00 2.2684e-02 3.9710e-02 1.4421e-03 1.2742e-02 -6.0000e+00 2.4553e-02 -3.0856e-03 8.4333e-04 6.2818e-03 -6.0000e+00 1.4593e-02 -3.3853e-03 3.9682e-04 1.8162e-03 -6.0000e+00 6.1869e-03 1.1739e-03 1.9278e-04 2.8879e-05 2.2616e-05 -6.0000e+00 4.5005e-04 -2.9800e-03 7.1326e-05 11 9 0 11 8 0 99.99 21.47 0.20 -0.00298 -0.00153 95 23 1 5 0 507.890 25.90 20.00 21.47 14.27 37.5 984.73 567 -433 404 -3208 -11676 -1823 -392 468 1959 -55 -4314 -1793 -169 -674 574 623 -914 1594 586 2290 638 -85 1372 1606 172 1134 30 -644 -815 -260 1776 733 2182 151 -4709 -2068 -1999 -1064 -6 226 -956 -1054 -267 -928 -533 -10 -579 51 -921 -643 1236 1289 829 1498 93 931 1041 585 118 455 485 1406 1269 2393 773 -1519 -509 -1642 988 1635 356 600 -41 564 202 -759 -861 -2287 -805 -352 -1272 -1019 -2067 -2001 -418 -526 68 167 956 497 564 237 -995 -189 732 339 -128 1347 779 -445 -515 -1692 -1792 130 390 -1206 -280 -500 -220 425 927 424 301 -32 -350 -227 434 -221 620 708 -86 -203 665 166 839 607 -981 536 855 340 461 -563 -704 -314 495 -5 -368 458 167 -434 -121 -808 90 -73 68 -504 -1835 -285 -65 79 351 -10 -836 -365 -38 -174 164 191 -270 481 184 733 208 -28 461 566 64 425 11 -223 -271 -87 625 275 871 61 -1864 -836 -904 -518 -3 135 -615 -703 -181 -633 -362 -7 -380 33 -588 -419 844 929 630 1111 71 722 813 454 91 353 395 1220 1107 2145 674 -1329 -424 -1383 893 1534 358 616 -42 541 179 -650 -687 -1823 -687 -314 -1266 -1044 -2248 -2298 -483 -642 86 204 1201 592 653 253 -1065 -203 793 383 -160 1711 1015 -563 -645 -1999 -2083 158 507 -1571 -381 -677 -314 636 1361 645 436 -45 -460 -288 560 -300 854 1014 -125 -288 959 229 1098 799 -1267 710 1143 482 647 -814 -1048 -487 773 -8 -610 735 278 -704 -190 -1242 SS 20240327T135524.7Z 8852.580147 331 1 10.23 2 55.87 120.87 116.10 273.71 0.00 1 0.00 1 0 25 1.157e-02 8.108e-03 1.172e-03 6.256e-04 2.381925e-01 3.353559e-04 2.898734e-03 -6.000000e+00 6.976562e-03 227.14 -2.00 3.52 -2.00 315.93 0.00e+00 4.176017e-04 3.438860e-05 4.714557e-05 -6.000000e+00 3.027557e-04 278.18 -2.00 20.00 -2.00 315.33 0.00e+00 1.777 0.000 302.00 328.00 3 1.8451e+00 8.6571e-04 2.1577e-02 -6.0000e+00 1.7329e-02 1.9502e-02 9.6272e-04 1.2208e-02 -6.0000e+00 1.8759e-02 -2.5710e-03 5.5483e-04 6.0121e-03 -6.0000e+00 1.1149e-02 -2.2666e-03 2.5266e-04 1.7143e-03 -6.0000e+00 4.7255e-03 1.0686e-02 -7.2710e-05 1.9308e-05 2.2742e-05 -6.0000e+00 3.4394e-04 -2.4215e-03 1.6511e-05 12 9 1 12 1 1 98.97 21.47 0.19 -0.00242 -0.00297 96 110 1 5 0 105.450 25.90 20.00 21.47 14.77 37.5 986.65 685 -942 -57 -3252 -5042 -2139 -1055 728 725 213 -3767 -1635 -203 -92 1135 654 -670 1080 647 1848 1063 -499 1027 935 434 1399 365 -910 -1023 294 1562 335 2411 -6 -4338 -2414 -1773 -682 284 167 -1024 -1143 -286 -833 -451 62 -771 -159 -675 -241 1267 671 648 1489 184 850 1213 390 254 518 513 1242 1273 2119 552 -1420 -418 -1669 734 1616 325 463 -111 655 188 -807 -809 -2087 -468 -297 -1153 -727 -2206 -2097 -458 -427 50 187 812 448 340 357 -763 -7 843 373 -28 1269 672 -427 -397 -1518 -1626 316 339 -1330 -257 -851 -252 246 809 365 190 66 -265 -218 590 -206 581 517 20 -157 676 47 974 955 -773 563 959 368 533 -550 -667 -399 449 -127 -468 371 118 -401 -17 -823 149 -217 -13 -692 -1004 -417 -219 165 178 54 -980 -447 -57 -29 397 228 -243 403 249 729 424 -201 425 407 197 599 165 -387 -416 120 670 153 1085 -3 -1929 -1105 -903 -377 173 115 -713 -826 -210 -614 -331 45 -547 -110 -462 -168 928 522 501 1196 152 713 1024 328 211 435 429 1111 1154 1977 501 -1270 -356 -1437 679 1567 323 470 -111 650 172 -707 -695 -1785 -406 -274 -1183 -773 -2392 -2402 -533 -504 61 232 990 539 394 380 -802 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