File name: Pandora64s1_NewHavenCT_20240518_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240519T045727.4Z 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_20240518_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: 20240518 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 20240518T150952.5Z 8904.631857 327 1 49.91 2 29.99 128.50 131.80 39.63 0.00 1 0.00 1 0 17 1.278e-02 9.490e-03 2.242e-03 1.450e-03 1.884106e-01 7.933291e-04 2.282716e-03 -6.000000e+00 7.832819e-03 231.35 -2.00 3.52 -2.00 315.19 0.00e+00 5.144691e-04 7.013337e-05 5.486142e-05 -6.000000e+00 3.424372e-04 283.81 -2.00 20.00 -2.00 314.57 0.00e+00 1.154 0.000 302.00 328.00 3 5.6700e+00 2.0505e-03 1.5289e-02 -6.0000e+00 1.9616e-02 3.9284e-02 2.2650e-03 9.7951e-03 -6.0000e+00 2.1146e-02 -4.2129e-03 1.2943e-03 4.7630e-03 -6.0000e+00 1.2566e-02 -2.0596e-03 5.6921e-04 1.3314e-03 -6.0000e+00 5.3111e-03 4.6193e-04 4.4073e-05 4.4611e-05 1.8531e-05 -6.0000e+00 3.8039e-04 -4.7070e-03 6.8072e-05 12 8 8 10 0 0 99.87 21.54 -0.09 -0.00471 -0.00438 15 4 1 5 0 3326.720 26.00 20.01 21.54 22.00 39.2 1023.62 1648 -663 681 -2598 -5135 -1855 -536 494 2342 325 -4256 -1541 -677 -616 1509 1240 -892 1177 374 2121 827 218 780 1154 14 1129 132 -920 -811 -1267 960 1081 2644 122 -5301 -1362 -2093 -1670 107 717 -737 -821 -48 -711 -356 327 -794 -179 -868 -1295 988 1520 1042 1439 279 687 1313 299 445 486 406 1308 1437 2555 847 -1920 -741 -1961 263 1774 933 490 55 655 -190 -1275 -985 -2367 -1009 -482 -1321 -1329 -1965 -1973 -121 -143 273 459 1170 502 179 428 -1501 -892 538 489 117 1248 773 -536 -450 -1686 -2065 -144 185 -1365 -364 -138 -45 664 1220 650 454 306 -415 -591 33 -420 658 548 -6 95 747 305 1120 684 -994 550 708 398 377 -484 -846 -416 491 -29 -222 490 372 -599 -275 -1010 487 -207 209 -740 -1437 -502 -153 146 733 106 -1411 -524 -254 -244 647 538 -401 538 176 1012 400 105 387 593 8 609 70 -454 -378 -593 461 540 1386 64 -2750 -708 -1168 -1034 73 528 -582 -670 -39 -567 -293 264 -625 -136 -674 -982 774 1243 860 1232 244 610 1167 266 390 431 363 1239 1388 2515 807 -1777 -668 -1772 245 1743 978 511 56 663 -185 -1170 -864 -2045 -889 -452 -1323 -1399 -2179 -2234 -140 -176 338 576 1440 605 205 463 -1583 -935 574 550 140 1547 980 -661 -538 -1971 -2388 -175 232 -1748 -471 -185 -61 941 1716 925 630 404 -527 -723 41 -531 885 750 -8 129 985 394 1415 827 -1211 679 895 512 503 -660 -1149 -589 709 -43 -332 741 559 -883 -405 -1457 SS 20240518T152308.7Z 8904.641073 337 1 47.06 2 28.11 133.64 130.26 43.34 0.00 1 0.00 1 0 17 1.345e-02 9.162e-03 1.607e-03 1.079e-03 1.824365e-01 5.907948e-04 2.203491e-03 -6.000000e+00 8.243174e-03 231.35 -2.00 3.52 -2.00 315.03 0.00e+00 5.879864e-04 5.081479e-05 2.880058e-05 -6.000000e+00 3.603718e-04 283.81 -2.00 20.00 -2.00 314.43 0.00e+00 1.133 0.000 302.00 328.00 3 5.0492e+00 1.5250e-03 1.4917e-02 -6.0000e+00 2.0644e-02 4.3774e-02 1.6823e-03 9.4887e-03 -6.0000e+00 2.2253e-02 -6.0538e-03 9.6088e-04 4.6064e-03 -6.0000e+00 1.3225e-02 -1.5487e-03 4.2118e-04 1.3088e-03 -6.0000e+00 5.5896e-03 8.8750e-04 5.8099e-05 3.3101e-05 1.7929e-05 -6.0000e+00 4.0030e-04 -5.1147e-03 6.3477e-05 12 9 1 12 1 1 99.94 21.53 0.13 -0.00511 -0.00468 33 8 1 5 0 1383.860 26.00 20.00 21.53 22.77 39.3 1027.11 1089 64 1055 -2101 -9267 -698 -625 507 1599 770 -3228 -1706 -374 131 981 1100 -431 1147 757 1964 1491 95 1052 1035 500 944 414 -922 -874 -675 1701 -155 2874 45 -4237 -2510 -1761 -1052 337 375 -938 -1087 -314 -1145 -475 73 -487 -221 -702 -799 1169 1105 1235 1281 256 825 1343 486 237 451 422 1282 1376 2045 923 -1653 -683 -1595 434 1586 420 604 -300 748 115 -917 -957 -2528 -889 -325 -1391 -1137 -2122 -2071 -426 -340 235 240 1010 580 43 347 -1247 -320 706 468 -242 1363 896 -312 -485 -1432 -1843 221 372 -1143 -289 -333 -273 563 894 455 383 -24 -328 -165 410 -284 573 612 223 -23 672 45 1050 892 -1078 494 893 211 461 -652 -762 -469 507 126 -516 307 226 -472 -182 -763 344 21 342 -631 -2890 -199 -190 158 532 262 -1113 -610 -147 53 438 518 -209 567 383 960 733 47 530 543 272 519 222 -463 -437 -336 867 -79 1518 24 -2315 -1330 -1031 -676 239 284 -761 -871 -255 -933 -383 60 -391 -172 -534 -614 930 923 1027 1108 226 737 1203 434 210 403 394 1215 1378 2011 909 -1522 -618 -1439 402 1608 437 643 -316 748 110 -840 -845 -2200 -781 -315 -1430 -1217 -2307 -2374 -499 -406 291 302 1244 703 50 382 -1289 -327 762 530 -291 1679 1128 -382 -580 -1681 -2141 259 465 -1454 -383 -442 -379 786 1274 638 525 -31 -414 -201 504 -355 763 826 305 -31 907 58 1324 1073 -1318 590 1121 269 608 -880 -1017 -651 714 184 -751 452 331 -699 -262 -1074 SS 20240518T153935.2Z 8904.652491 349 1 48.87 2 26.01 140.78 128.19 47.70 0.00 1 0.00 1 0 17 1.723e-02 1.008e-02 2.404e-03 1.516e-03 1.834449e-01 8.302398e-04 2.208638e-03 -6.000000e+00 1.055985e-02 231.35 -2.00 3.52 -2.00 315.30 0.00e+00 7.674305e-04 7.521392e-05 3.346844e-05 -6.000000e+00 4.616208e-04 283.81 -2.00 20.00 -2.00 314.68 0.00e+00 1.112 0.000 302.00 328.00 3 5.6682e+00 2.1468e-03 1.4800e-02 -6.0000e+00 2.6446e-02 5.5042e-02 2.3715e-03 9.5543e-03 -6.0000e+00 2.8505e-02 -8.3453e-03 1.3560e-03 4.6237e-03 -6.0000e+00 1.6940e-02 -3.7494e-04 5.9816e-04 1.3450e-03 -6.0000e+00 7.1616e-03 4.8440e-04 2.9668e-04 4.6917e-05 1.7666e-05 -6.0000e+00 5.1256e-04 -5.2787e-03 1.2054e-04 12 8 8 10 0 0 99.97 21.53 0.05 -0.00528 -0.00305 36 9 1 5 0 1357.480 26.00 20.01 21.53 23.41 39.3 1030.37 788 689 830 -1714 -14471 117 -647 991 1488 761 -4627 -1005 -448 149 857 1532 -647 1661 626 3080 1203 933 1795 1917 535 1032 282 -1217 -1365 -1365 1071 -260 2638 -137 -4617 -2397 -1498 -1205 376 509 -468 -1018 -291 -1258 -292 -74 -181 -71 -600 -887 1123 1059 1162 1159 414 450 1333 -85 324 288 632 931 1341 2317 881 -1657 -974 -1867 500 1641 645 566 170 854 121 -1299 -1138 -2795 -1332 -523 -1239 -1416 -1955 -2137 -124 -293 572 349 1250 597 108 188 -1517 -742 264 463 -43 1517 925 -262 -341 -1669 -2358 -181 279 -1158 -151 -122 -35 730 1151 846 305 141 -584 -442 -16 -366 327 738 -16 328 849 184 896 685 -1235 380 787 391 400 -562 -990 -436 596 23 -216 439 417 -569 -242 -925 232 209 250 -476 -4145 29 -171 284 456 239 -1491 -329 -152 56 353 661 -289 751 292 1445 575 442 870 911 265 517 138 -592 -629 -627 504 -129 1351 -71 -2321 -1226 -798 -743 254 385 -359 -809 -235 -1018 -233 -59 -138 -55 -456 -682 849 840 959 995 362 399 1182 -75 283 255 555 871 1320 2327 854 -1501 -874 -1671 454 1633 654 589 175 872 114 -1178 -950 -2303 -1159 -501 -1247 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