File name: Pandora64s1_NewHavenCT_20241003_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20241004T051937.5Z 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 v1.8.60 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20241003_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: 20241003 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 20241003T142628.6Z 9042.601720 162 1 48.39 2 54.89 137.72 63.60 132.91 0.00 1 0.00 1 0 17 1.415e-02 8.468e-03 2.029e-03 1.008e-03 2.261627e-01 5.411616e-04 2.756591e-03 -6.000000e+00 8.538767e-03 227.12 -2.00 3.52 -2.00 316.15 0.00e+00 4.755618e-04 5.992511e-05 8.395566e-05 -6.000000e+00 3.815866e-04 285.36 -2.00 20.00 -2.00 315.44 0.00e+00 1.734 0.000 302.00 328.00 3 4.2796e+00 1.3990e-03 2.0874e-02 -6.0000e+00 2.1156e-02 3.2097e-02 1.5578e-03 1.1631e-02 -6.0000e+00 2.2869e-02 6.6236e-04 8.9918e-04 5.7119e-03 -6.0000e+00 1.3651e-02 -4.3110e-03 4.1493e-04 1.6218e-03 -6.0000e+00 5.8298e-03 9.9291e-04 1.2159e-04 3.1267e-05 2.1305e-05 -6.0000e+00 4.2068e-04 -4.5861e-03 8.4580e-05 11 8 0 10 0 0 99.99 21.55 0.04 -0.00459 -0.00367 69 17 1 5 0 701.190 26.00 20.01 21.55 27.65 40.3 1029.75 1190 -588 358 -2279 -10379 -1207 -930 1332 1385 1419 -3980 -1146 -232 -412 779 684 -540 1258 247 2155 1014 252 1078 1078 126 1416 149 -952 -1091 -343 1496 18 2323 -12 -4520 -2475 -1966 -1139 261 148 -1287 -972 -292 -1061 -398 -124 -497 -138 -782 -599 1273 1290 1103 1394 347 727 1336 422 304 476 529 1455 1327 2085 699 -1555 -484 -1516 663 1670 442 478 41 590 276 -984 -621 -2406 -630 -336 -1283 -962 -2112 -2028 -560 -382 246 170 916 451 409 334 -792 -230 861 387 -32 1111 739 -437 -536 -1584 -2000 106 297 -1398 -288 -440 -273 561 911 484 320 35 -302 -114 397 -208 502 551 5 -122 611 17 987 784 -956 577 988 355 411 -560 -738 -340 498 -54 -453 397 176 -404 -54 -809 233 -122 74 -436 -1971 -210 -173 269 303 318 -927 -277 -63 -118 246 231 -189 451 92 814 389 97 403 423 51 585 61 -386 -422 -133 605 7 994 -5 -1911 -1072 -947 -602 153 98 -870 -679 -208 -758 -282 -87 -340 -97 -541 -421 890 952 854 1075 275 585 1079 340 242 384 446 1304 1211 1960 637 -1393 -411 -1296 582 1612 438 486 41 585 253 -860 -526 -2031 -539 -306 -1299 -1015 -2272 -2303 -649 -467 301 211 1117 541 470 368 -822 -238 950 451 -39 1417 964 -555 -665 -1854 -2403 128 370 -1836 -380 -605 -382 819 1366 716 450 47 -395 -143 506 -279 693 795 7 -175 848 23 1285 1014 -1211 746 1303 495 575 -805 -1053 -506 754 -85 -730 626 285 -638 -83 -1256 SS 20241003T143118.8Z 9042.605078 165 1 15.51 2 54.29 139.00 62.97 134.02 0.00 1 0.00 1 0 17 1.204e-02 8.297e-03 1.721e-03 9.703e-04 2.235448e-01 5.214953e-04 2.735026e-03 -6.000000e+00 7.262806e-03 227.12 -2.00 3.52 -2.00 315.74 0.00e+00 3.830268e-04 5.264775e-05 4.799221e-05 -6.000000e+00 3.246047e-04 285.36 -2.00 20.00 -2.00 315.06 0.00e+00 1.708 0.000 302.00 328.00 3 3.1897e+00 1.3410e-03 2.0589e-02 -6.0000e+00 1.7995e-02 2.5956e-02 1.4901e-03 1.1491e-02 -6.0000e+00 1.9453e-02 -6.8188e-04 8.5733e-04 5.6479e-03 -6.0000e+00 1.1613e-02 -3.5591e-03 3.8953e-04 1.6001e-03 -6.0000e+00 4.9576e-03 3.0514e-03 -2.3948e-04 2.9868e-05 2.1590e-05 -6.0000e+00 3.5798e-04 -3.9236e-03 2.1213e-05 12 9 1 12 1 1 97.60 21.55 0.17 -0.00392 -0.00572 40 31 1 5 0 378.210 26.00 20.01 21.55 27.94 40.3 1031.41 226 -717 508 -3109 -6439 -1794 -794 1205 1268 -246 -3335 -1216 -110 28 1060 1119 -1029 1165 98 1862 1562 -297 1113 1264 504 1022 184 -1070 -995 316 1994 362 1953 -102 -4610 -2069 -1689 -1071 211 93 -947 -831 -476 -1032 -470 34 -782 172 -737 -298 1247 969 998 1317 243 976 1080 546 322 398 428 1283 1367 2126 563 -1580 -115 -1661 576 1574 165 416 -39 495 268 -917 -566 -2189 -724 -372 -1155 -863 -1971 -2141 -456 -349 189 140 839 521 295 498 -703 -81 867 407 -37 1079 621 -336 -425 -1591 -1762 159 444 -1461 -315 -711 -178 354 930 207 352 139 -201 -169 553 -103 469 403 -103 -151 657 108 987 925 -904 642 1011 525 559 -419 -687 -401 408 -157 -496 258 144 -436 -111 -750 54 -180 126 -720 -1412 -377 -178 293 334 -67 -927 -353 -33 9 391 409 -393 454 40 767 647 -125 479 569 237 488 86 -472 -417 132 869 169 960 -51 -2232 -1021 -867 -598 137 64 -702 -602 -352 -764 -346 25 -588 125 -532 -218 902 742 801 1101 197 804 897 451 264 329 370 1182 1271 2035 523 -1451 -100 -1457 515 1547 166 427 -40 500 250 -821 -495 -1903 -635 -344 -1188 -920 -2128 -2445 -528 -428 230 174 1019 625 341 529 -736 -85 966 476 -45 1367 806 -424 -526 -1861 -2030 192 549 -1911 -412 -972 -245 510 1323 303 487 185 -261 -211 700 -138 642 555 -144 -214 904 141 1279 1195 -1145 829 1326 699 774 -596 -967 -588 607 -243 -758 400 222 -678 -167 -1106 SS 20241003T143545.2Z 9042.608161 168 1 48.30 2 53.75 140.19 62.40 135.05 0.00 1 0.00 1 0 17 1.134e-02 8.180e-03 2.404e-04 1.367e-04 2.192685e-01 7.345571e-05 2.683528e-03 -6.000000e+00 6.841332e-03 227.12 -2.00 3.52 -2.00 315.72 0.00e+00 3.541294e-04 7.379577e-06 5.234997e-05 -6.000000e+00 3.057429e-04 285.36 -2.00 20.00 -2.00 315.03 0.00e+00 1.687 0.000 302.00 328.00 3 4.8071e-01 1.8885e-04 2.0283e-02 -6.0000e+00 1.6951e-02 4.0031e-03 2.0978e-04 1.1272e-02 -6.0000e+00 1.8323e-02 7.1354e-04 1.2064e-04 5.5397e-03 -6.0000e+00 1.0938e-02 -3.9521e-03 5.4691e-05 1.5674e-03 -6.0000e+00 4.6704e-03 4.7631e-02 -4.2790e-05 4.2211e-06 2.1550e-05 -6.0000e+00 3.3714e-04 -4.3530e-03 4.8441e-05 11 8 0 10 0 0 99.86 21.54 0.22 -0.00435 -0.00467 2281 549 1 5 0 21.170 26.00 20.01 21.54 28.25 40.3 1033.32 643 -897 156 -3232 -4638 -1905 -879 717 954 -70 -3486 -1737 -128 -69 1016 734 -686 980 536 1701 1187 -315 894 913 483 1136 562 -911 -739 189 1698 97 2321 -161 -4457 -2439 -1744 -1124 278 151 -911 -1026 -220 -839 -314 115 -589 -79 -623 -241 1233 1013 815 1460 281 863 1172 613 156 373 544 1306 1225 2166 606 -1448 -434 -1605 591 1519 299 421 -170 568 124 -781 -965 -2097 -665 -356 -1231 -766 -2094 -2076 -547 -472 42 127 852 462 367 416 -752 -15 881 358 -46 1186 668 -461 -466 -1501 -1738 153 405 -1338 -272 -734 -267 356 848 427 254 138 -198 -98 527 -208 578 469 -32 -210 643 61 947 936 -750 646 1027 451 570 -476 -665 -386 447 -144 -537 281 105 -508 -20 -778 155 -228 39 -760 -1013 -407 -199 178 256 -19 -984 -514 -38 -23 379 272 -264 386 218 708 498 -134 389 417 229 547 265 -405 -312 80 748 46 1146 -80 -2172 -1218 -903 -633 182 105 -643 -750 -164 -626 -233 84 -421 -58 -453 -178 900 782 660 1165 230 717 981 510 129 312 475 1155 1153 2094 569 -1274 -381 -1420 533 1437 303 437 -174 553 117 -707 -812 -1746 -590 -333 -1220 -788 -2290 -2294 -642 -562 52 160 1049 539 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