File name: Pandora64s1_NewHavenCT_20240521_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240522T054708.9Z 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_20240521_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: 20240521 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 20240521T144703.9Z 8907.616018 343 1 47.26 2 33.10 119.97 154.64 345.25 0.00 1 0.00 1 0 17 1.151e-02 9.096e-03 2.327e-03 1.495e-03 1.846122e-01 8.195101e-04 2.231736e-03 -6.000000e+00 7.061415e-03 231.53 -2.00 3.52 -2.00 315.21 0.00e+00 3.374413e-04 7.279718e-05 5.741591e-05 -6.000000e+00 3.088905e-04 284.10 -2.00 20.00 -2.00 314.58 0.00e+00 1.193 0.000 302.00 328.00 3 5.6151e+00 2.1177e-03 1.5445e-02 -6.0000e+00 1.7691e-02 4.2007e-02 2.3380e-03 9.5926e-03 -6.0000e+00 1.9066e-02 -6.3912e-04 1.3369e-03 4.6643e-03 -6.0000e+00 1.1331e-02 -3.8051e-03 5.8862e-04 1.2885e-03 -6.0000e+00 4.7887e-03 4.7351e-04 -2.2147e-05 4.5908e-05 1.8185e-05 -6.0000e+00 3.4274e-04 -5.1960e-03 4.8081e-05 11 9 0 11 8 0 99.88 21.57 -0.09 -0.00520 -0.00536 19 5 1 5 0 2486.710 26.00 20.01 21.57 23.75 39.0 1031.42 -561 48 978 -2518 -3374 304 -1127 388 1187 378 -3849 -761 -132 -602 1569 -243 -483 1247 133 1715 1787 -89 959 1642 1069 1025 57 -786 -1172 -1781 767 -334 2761 -100 -4433 -1844 -1727 -1422 155 -110 -550 -769 108 -1432 -448 271 -457 -245 -706 -1243 1350 660 830 1271 364 832 1452 283 269 70 212 1275 1522 2400 822 -1645 -501 -1773 716 1847 529 794 -95 641 220 -861 -628 -2548 -1023 -440 -1037 -1442 -1781 -1958 -590 -192 373 205 1082 464 179 474 -1356 -471 529 629 -36 1607 770 -323 -806 -1733 -2100 114 375 -1292 -324 -224 -290 384 1082 456 338 34 -215 -618 305 -323 430 690 144 16 779 163 945 768 -1301 769 751 311 484 -463 -773 -214 453 56 -449 371 380 -563 -240 -849 -171 15 301 -721 -887 77 -309 116 379 124 -1282 -259 -47 -239 673 -107 -216 567 63 819 853 -43 473 839 566 527 30 -387 -547 -833 367 -168 1434 -52 -2262 -956 -951 -908 110 -84 -427 -618 88 -1176 -363 216 -353 -191 -539 -964 1077 534 699 1110 312 722 1263 246 232 61 193 1181 1487 2394 791 -1539 -440 -1561 672 1830 542 831 -99 655 216 -768 -536 -2154 -914 -417 -1044 -1526 -1981 -2222 -688 -235 460 257 1330 559 206 515 -1438 -494 566 706 -43 2042 971 -408 -964 -2027 -2429 137 469 -1647 -429 -299 -405 541 1552 644 465 45 -271 -752 375 -419 575 934 198 22 1052 209 1191 956 -1585 945 943 411 640 -626 -1072 -298 646 83 -662 553 564 -843 -349 -1209 SS 20240521T145135.8Z 8907.619164 346 1 47.92 2 32.37 121.39 154.84 347.64 0.00 1 0.00 1 0 17 1.107e-02 8.501e-03 1.521e-03 1.002e-03 1.799940e-01 5.490339e-04 2.179793e-03 -6.000000e+00 6.787558e-03 231.53 -2.00 3.52 -2.00 315.12 0.00e+00 3.683452e-04 4.791331e-05 4.286439e-05 -6.000000e+00 2.969054e-04 284.11 -2.00 20.00 -2.00 314.49 0.00e+00 1.183 0.000 302.00 328.00 3 4.9012e+00 1.4185e-03 1.5220e-02 -6.0000e+00 1.7004e-02 2.9678e-02 1.5657e-03 9.3746e-03 -6.0000e+00 1.8326e-02 1.9441e-03 8.9426e-04 4.5560e-03 -6.0000e+00 1.0891e-02 -4.6579e-03 3.9159e-04 1.2641e-03 -6.0000e+00 4.6032e-03 9.8948e-04 5.9647e-05 3.0824e-05 1.7576e-05 -6.0000e+00 3.2941e-04 -5.4758e-03 5.7751e-05 11 8 0 10 0 0 99.54 21.58 0.15 -0.00548 -0.00503 43 10 1 5 0 1114.330 26.00 19.93 21.58 23.91 39.1 1032.29 1067 -700 123 -2493 -3436 -1149 -313 1740 1714 286 -3513 -1646 187 -571 1124 233 -604 652 217 1809 1294 115 1150 883 619 1074 508 -1103 -531 -635 1867 -292 2471 -270 -4284 -2564 -1540 -1281 501 52 -927 -1026 -143 -1194 -450 -247 -604 -251 -705 -680 1310 889 897 1337 390 730 1281 303 313 332 570 1288 1248 2190 734 -1509 -370 -1364 731 1618 496 521 -62 678 186 -748 -774 -2219 -868 -392 -1230 -1037 -2010 -1861 -502 -354 87 214 897 475 347 391 -1090 -250 745 279 -45 1333 784 -360 -535 -1370 -1871 129 325 -1321 -337 -375 -312 447 891 427 295 106 -386 -249 470 -281 485 653 -30 -89 665 101 942 792 -941 570 998 414 562 -558 -775 -432 523 42 -473 320 213 -415 -125 -877 331 -228 40 -738 -935 -327 -88 530 563 97 -1205 -583 72 -230 492 109 -288 318 102 865 623 55 567 455 330 580 267 -546 -262 -312 938 -147 1286 -141 -2180 -1337 -886 -807 345 41 -730 -835 -118 -989 -369 -199 -472 -199 -549 -534 1012 724 761 1176 334 634 1115 264 269 289 516 1238 1210 2168 700 -1407 -324 -1253 685 1588 521 537 -66 686 182 -667 -668 -1885 -780 -370 -1226 -1121 -2198 -2143 -589 -421 107 269 1105 577 405 418 -1141 -259 815 319 -54 1642 988 -440 -643 -1624 -2196 152 410 -1686 -448 -498 -432 621 1263 594 404 139 -491 -304 581 -352 649 880 -42 -120 902 131 1200 963 -1117 686 1263 529 743 -755 -1035 -600 735 62 -709 487 323 -614 -180 -1283 SS 20240521T145632.3Z 8907.622596 349 1 6.63 2 31.58 123.00 155.03 350.28 0.00 1 0.00 1 0 17 1.251e-02 8.904e-03 3.420e-03 2.371e-03 1.767211e-01 1.303097e-03 2.146590e-03 -6.000000e+00 7.667298e-03 231.53 -2.00 3.52 -2.00 314.88 0.00e+00 4.908932e-04 1.085038e-04 2.850026e-05 -6.000000e+00 3.354587e-04 284.11 -2.00 20.00 -2.00 314.28 0.00e+00 1.173 0.000 302.00 328.00 3 4.5452e+00 3.3607e-03 1.5035e-02 -6.0000e+00 1.9208e-02 2.3076e-02 3.7077e-03 9.2217e-03 -6.0000e+00 2.0705e-02 1.8292e-03 2.1169e-03 4.4743e-03 -6.0000e+00 1.2305e-02 -3.8926e-03 9.2043e-04 1.2553e-03 -6.0000e+00 5.1979e-03 1.4394e-03 -2.7373e-04 7.2648e-05 1.7863e-05 -6.0000e+00 3.7233e-04 -2.8088e-03 3.4163e-05 12 9 1 12 1 1 -58.02 21.56 0.12 -0.00281 -0.00487 5 11 1 5 0 1103.130 26.00 20.03 21.56 24.11 39.0 1032.61 2626 -400 1634 -3494 -6018 -1718 636 342 2510 -20 -2279 -1816 218 -273 2169 78 -498 898 742 2065 979 -331 1025 725 232 988 87 -1205 -364 -425 2250 -157 2463 398 -4457 -2218 -2227 -1088 431 197 -858 -1495 -300 -1291 -1144 419 -831 -494 -1409 -596 833 1404 485 1735 326 1289 1181 790 -21 686 356 1128 1366 2343 670 -1584 -589 -1140 509 1875 427 780 224 497 502 -933 -952 -2151 -755 -541 -859 -763 -2023 -2021 -573 -550 280 24 897 514 186 738 -989 -286 568 184 54 1243 563 -533 -328 -1473 -1334 119 346 -1315 -390 -826 -121 248 982 177 197 135 -262 -342 703 -209 615 393 168 -87 523 -29 1010 949 -489 452 1051 509 405 -353 -574 -567 256 -295 -489 346 11 -315 66 -766 856 -139 551 -1187 -1910 -522 201 120 869 -7 -819 -684 89 -117 1000 39 -252 438 370 1049 503 -171 539 398 132 567 49 -633 -190 -221 1193 -83 1360 219 -2409 -1222 -1296 -728 317 155 -688 -1245 -253 -1091 -962 342 -663 -400 -1118 -475 659 1157 421 1480 285 1136 1050 697 -18 607 330 1064 1358 2375 656 -1508 -528 -1015 487 1881 441 823 234 496 479 -849 -836 -1855 -688 -522 -874 -808 -2185 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