File name: Pandora64s1_NewHavenCT_20240806_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240807T050852.7Z 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_20240806_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: 20240806 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 20240806T130805.0Z 8984.547281 143 1 6.90 2 54.85 99.05 76.93 87.64 0.00 1 0.00 1 0 25 1.140e-02 7.595e-03 2.047e-03 1.019e-03 2.365708e-01 5.567717e-04 2.858528e-03 -6.000000e+00 7.004770e-03 232.14 -2.00 3.52 -2.00 316.16 0.00e+00 3.296872e-04 6.156913e-05 7.143111e-05 -6.000000e+00 3.131904e-04 289.84 -2.00 20.00 -2.00 315.36 0.00e+00 1.732 0.000 302.00 328.00 3 2.4094e+00 1.4536e-03 2.1432e-02 -6.0000e+00 1.7540e-02 -7.6011e-03 1.6101e-03 1.2431e-02 -6.0000e+00 1.8878e-02 -3.4427e-03 9.2674e-04 6.0164e-03 -6.0000e+00 1.1253e-02 -2.9219e-03 4.2552e-04 1.6502e-03 -6.0000e+00 4.7759e-03 6.4105e-03 -1.9427e-04 3.1609e-05 2.1818e-05 -6.0000e+00 3.3944e-04 -4.2313e-03 6.1210e-06 12 9 1 12 1 1 99.35 21.65 0.19 -0.00423 -0.00569 44 76 1 5 0 153.110 26.11 20.02 21.65 34.76 40.5 1071.66 1016 -1115 -174 -3601 -5628 -1148 -1315 421 1177 20 -3351 -1784 309 -218 1000 513 -460 1049 619 1423 1218 -78 1394 789 668 939 710 -656 -376 281 1703 -502 2315 -122 -4406 -2231 -1386 -1262 350 227 -1311 -1336 -113 -929 -513 -194 -674 -230 -641 -222 1091 375 799 1197 141 684 1122 401 195 663 685 1135 1140 1993 740 -1303 110 -1196 896 1645 184 370 -155 529 -48 -566 -684 -2036 -579 -288 -1234 -654 -1997 -1939 -479 -428 128 124 857 413 317 514 -474 177 1119 550 -210 940 456 -568 -494 -1337 -1559 242 339 -1303 -298 -697 -379 335 750 346 183 233 -99 104 609 -210 485 342 -152 -335 555 -31 944 795 -806 619 1029 439 472 -498 -595 -305 329 -185 -497 324 147 -406 18 -640 197 -231 -36 -693 -1014 -199 -247 86 260 5 -784 -441 84 -62 315 174 -162 380 232 548 472 -30 520 311 274 393 290 -253 -148 112 711 -209 1012 -54 -1907 -990 -684 -679 206 150 -883 -934 -80 -662 -364 -136 -463 -154 -424 -150 773 283 595 931 113 556 918 327 158 540 584 982 1051 1797 681 -1127 95 -1046 800 1540 185 381 -158 510 -45 -483 -574 -1698 -515 -271 -1228 -673 -2190 -2145 -564 -509 158 156 1057 484 358 559 -485 182 1224 633 -255 1180 587 -710 -606 -1616 -1858 289 434 -1690 -404 -948 -542 482 1112 506 254 313 -129 131 778 -283 671 495 -214 -482 773 -43 1241 1042 -1036 814 1375 596 669 -726 -858 -460 503 -294 -782 516 234 -650 28 -973 SS 20240806T131239.4Z 8984.550456 146 1 22.83 2 54.01 99.91 76.10 88.37 0.00 1 0.00 1 0 17 1.134e-02 7.578e-03 1.422e-03 6.940e-04 2.318272e-01 3.783438e-04 2.799011e-03 -6.000000e+00 6.973070e-03 232.14 -2.00 3.52 -2.00 316.21 0.00e+00 3.344946e-04 4.227008e-05 7.486006e-05 -6.000000e+00 3.117387e-04 289.84 -2.00 20.00 -2.00 315.40 0.00e+00 1.697 0.000 302.00 328.00 3 2.8513e+00 9.8871e-04 2.0998e-02 -6.0000e+00 1.7461e-02 -4.4573e-03 1.0961e-03 1.2178e-02 -6.0000e+00 1.8791e-02 -1.5286e-03 6.3154e-04 5.8935e-03 -6.0000e+00 1.1201e-02 -3.9559e-03 2.9069e-04 1.6191e-03 -6.0000e+00 4.7550e-03 4.2915e-03 5.9924e-05 2.1575e-05 2.1347e-05 -6.0000e+00 3.3780e-04 -4.5846e-03 5.3274e-05 12 9 1 12 1 1 99.99 21.65 0.20 -0.00458 -0.00413 126 65 1 5 0 179.720 26.11 20.01 21.65 34.92 40.6 1073.24 785 -558 429 -3449 -6038 -1958 -416 822 1044 561 -3024 -1104 21 105 855 551 -779 1255 12 1720 800 -359 926 795 784 991 321 -749 -520 260 1577 185 2109 -157 -4399 -2111 -1792 -820 -134 15 -998 -1063 -254 -885 -560 -149 -864 -196 -730 -467 1093 1192 798 1460 65 603 1144 323 190 461 530 1323 1091 2136 660 -1297 -7 -1313 871 1560 314 424 -150 321 161 -668 -609 -1913 -595 -330 -1199 -741 -1889 -1864 -386 -382 136 130 773 511 401 615 -610 115 1007 338 -144 959 468 -561 -464 -1432 -1725 130 259 -1361 -376 -657 -330 271 705 260 257 161 -221 -15 590 -194 524 448 -134 -227 551 -38 880 1003 -682 676 1025 491 470 -430 -572 -347 463 -98 -494 266 2 -402 -31 -679 148 -111 85 -640 -1056 -361 -75 162 223 123 -679 -260 5 31 258 178 -262 433 4 630 297 -134 357 322 329 425 135 -296 -195 98 625 78 941 -70 -1938 -952 -838 -445 -79 9 -672 -742 -180 -631 -398 -104 -594 -131 -483 -315 772 888 590 1122 51 486 927 261 152 373 448 1128 992 1995 599 -1104 -6 -1134 763 1511 309 427 -149 304 149 -593 -502 -1567 -521 -304 -1164 -781 -2013 -2099 -440 -461 170 158 968 606 461 648 -638 120 1068 396 -176 1210 605 -704 -575 -1673 -1988 157 319 -1775 -512 -894 -473 390 1042 380 372 216 -289 -18 755 -263 722 646 -196 -326 765 -52 1157 1318 -878 891 1368 663 662 -622 -851 -518 727 -154 -795 434 4 -636 -48 -1062 SS 20240806T131739.4Z 8984.553928 149 1 48.38 2 53.08 100.86 75.20 89.19 0.00 1 0.00 1 0 17 1.071e-02 7.596e-03 5.590e-04 2.981e-04 2.266198e-01 1.626278e-04 2.738433e-03 -6.000000e+00 6.581222e-03 232.14 -2.00 3.52 -2.00 315.95 0.00e+00 2.769422e-04 1.715588e-05 5.911299e-05 -6.000000e+00 2.942558e-04 289.84 -2.00 20.00 -2.00 315.17 0.00e+00 1.661 0.000 302.00 328.00 3 2.0217e+00 4.2360e-04 2.0534e-02 -6.0000e+00 1.6480e-02 -1.0551e-02 4.6936e-04 1.1896e-02 -6.0000e+00 1.7736e-02 -2.1183e-03 2.6916e-04 5.7584e-03 -6.0000e+00 1.0573e-02 -3.2788e-03 1.2208e-04 1.5781e-03 -6.0000e+00 4.4871e-03 1.0321e-02 -2.7325e-04 9.2109e-06 2.1274e-05 -6.0000e+00 3.1892e-04 -4.3160e-03 -1.0066e-06 11 9 0 11 8 0 97.24 21.66 0.18 -0.00432 -0.00637 478 115 1 5 0 101.200 26.11 19.98 21.66 35.39 40.6 1076.89 556 -1119 33 -3154 -4618 -1676 -384 897 1241 114 -2839 -1435 104 -114 1031 674 -781 928 331 1770 1279 -168 957 920 401 992 610 -838 -422 423 1711 126 2149 -139 -4302 -2175 -1680 -867 103 27 -1004 -1080 -415 -970 -510 -68 -834 -173 -641 -327 1154 711 649 1320 244 722 1041 515 144 518 552 1261 1087 2038 513 -1151 -31 -1252 871 1630 234 400 -160 515 134 -720 -649 -1862 -548 -355 -1291 -750 -1956 -1890 -400 -407 81 108 843 453 472 557 -501 174 959 425 -124 947 447 -547 -456 -1397 -1613 136 327 -1380 -274 -761 -279 237 679 279 147 122 -29 36 677 -198 497 296 -147 -295 522 -22 926 1037 -636 672 997 386 569 -388 -603 -340 422 -142 -522 267 65 -496 11 -670 121 -259 8 -674 -918 -326 -79 203 304 29 -732 -390 29 -36 355 249 -300 340 126 685 500 -66 389 393 178 448 269 -349 -167 167 710 56 1004 -65 -1981 -1027 -825 -494 65 18 -715 -798 -295 -691 -362 -51 -605 -122 -447 -232 857 529 507 1073 203 581 843 415 115 418 467 1137 993 1912 468 -1033 -26 -1075 804 1577 231 406 -161 515 124 -637 -563 -1600 -476 -327 -1258 -794 -2101 -2145 -462 -497 99 133 1023 545 547 593 -525 183 1024 478 -154 1211 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