File name: Pandora75s1_EssexMD_20240912_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250116T080041.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.70 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20240912_L1_smca1c3d20230525p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20240912 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: OoB session based on session 2 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0305 305.1717 305.3128 305.4540 305.5951 305.7363 305.8774 306.0185 306.1596 306.3007 306.4418 306.5828 306.7239 306.8649 307.0060 307.1470 307.2880 307.4290 307.5700 307.7110 307.8519 307.9929 308.1338 308.2747 308.4157 308.5566 308.6975 308.8384 308.9792 309.1201 309.2610 309.4018 309.5426 309.6834 309.8243 309.9651 310.1058 310.2466 310.3874 310.5281 310.6689 310.8096 310.9503 311.0910 311.2317 311.3724 311.5131 311.6537 311.7944 311.9350 312.0757 312.2163 312.3569 312.4975 312.6381 312.7786 312.9192 313.0598 313.2003 313.3408 313.4813 313.6218 313.7623 313.9028 314.0433 314.1838 314.3242 314.4646 314.6051 314.7455 314.8859 315.0263 315.1667 315.3070 315.4474 315.5877 315.7281 315.8684 316.0087 316.1490 316.2893 316.4296 316.5699 316.7101 316.8504 316.9906 317.1308 317.2710 317.4112 317.5514 317.6916 317.8318 317.9719 318.1121 318.2522 318.3923 318.5324 318.6725 318.8126 318.9527 319.0927 319.2328 319.3728 319.5129 319.6529 319.7929 319.9329 320.0729 320.2128 320.3528 320.4927 320.6327 320.7726 320.9125 321.0524 321.1923 321.3322 321.4721 321.6119 321.7518 321.8916 322.0314 322.1712 322.3110 322.4508 322.5906 322.7304 322.8701 323.0099 323.1496 323.2893 323.4290 323.5687 323.7084 323.8481 323.9877 324.1274 324.2670 324.4067 324.5463 324.6859 324.8255 324.9650 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20240912T151501.8Z 9021.635438 5 1 51.65 2 42.97 138.81 140.95 88.84 0.00 1 0.00 1 0 25 1.010e-02 7.801e-03 1.413e-04 9.528e-05 1.922147e-01 5.085363e-05 2.284340e-03 -6.000000e+00 6.080020e-03 229.46 -2.00 3.48 -2.00 315.04 0.00e+00 6.264613e-04 4.554755e-06 7.648304e-05 -6.000000e+00 2.753523e-04 289.13 -2.00 20.00 -2.00 314.35 0.00e+00 1.365 0.000 302.00 328.00 3 2.3760e-01 1.3067e-04 1.6812e-02 -6.0000e+00 1.5113e-02 2.6917e-03 1.4522e-04 9.7404e-03 -6.0000e+00 1.6363e-02 1.0607e-03 8.2859e-05 4.7311e-03 -6.0000e+00 9.7827e-03 -6.1372e-03 3.5712e-05 1.3163e-03 -6.0000e+00 4.0790e-03 8.7147e-02 -8.0321e-05 2.9986e-06 1.9503e-05 -6.0000e+00 3.1291e-04 7.6098e-03 -8.7009e-07 11 8 0 10 0 0 72.11 22.07 0.46 0.00761 0.00701 3430 558 1 5 0 15.040 24.86 20.01 22.07 35.30 4.9 1054.78 618 196 -920 -2237 -2882 -2042 -1159 -106 -123 -1525 -2355 -1858 -936 -208 506 270 372 891 1406 1382 1335 1231 1592 1440 1291 1091 128 -530 -151 264 590 1205 478 -1489 -2983 -2955 -2487 -1390 -267 -542 -717 -418 -323 -188 -17 109 -202 -458 -433 57 502 851 1026 1041 775 882 725 268 231 568 1107 1639 1904 1420 551 -273 -574 -235 572 1112 627 702 612 387 -48 -811 -1380 -1681 -1683 -1575 -1781 -1948 -1988 -1711 -840 -449 225 576 500 452 370 -31 -404 -139 -89 113 460 533 119 -304 -903 -1312 -825 -464 -857 -954 -526 -312 437 817 815 600 403 86 -91 -35 128 393 468 354 375 531 566 634 668 312 253 383 301 126 -156 -387 -199 40 96 119 366 246 51 -26 -467 -897 -1007 195 67 -302 -761 -896 -594 -343 -34 -43 -527 -823 -655 -353 -87 218 127 171 418 676 683 670 618 808 759 709 581 68 -287 -77 129 294 631 266 -808 -1680 -1639 -1384 -828 -175 -390 -539 -329 -260 -153 -13 87 -159 -350 -338 44 400 678 859 868 666 770 641 237 202 497 991 1485 1841 1379 533 -259 -507 -211 509 1087 642 720 630 386 -47 -754 -1226 -1490 -1466 -1439 -1734 -1994 -2172 -1890 -946 -538 272 715 620 540 426 -34 -424 -147 -93 125 535 650 147 -384 -1086 -1536 -963 -537 -1027 -1212 -673 -416 586 1109 1147 845 563 115 -117 -43 155 495 608 473 513 721 750 831 861 383 311 473 375 166 -208 -528 -267 56 136 177 541 371 77 -38 -677 -1311 -1459 SS 20240912T152015.6Z 9021.639070 8 1 51.65 2 42.32 140.48 139.99 89.64 0.00 1 0.00 1 0 17 1.005e-02 7.762e-03 1.394e-04 9.513e-05 1.903098e-01 5.094835e-05 2.264003e-03 -6.000000e+00 6.048719e-03 229.46 -2.00 3.48 -2.00 314.98 0.00e+00 6.248367e-04 4.493659e-06 7.322327e-05 -6.000000e+00 2.738682e-04 289.13 -2.00 20.00 -2.00 314.28 0.00e+00 1.351 0.000 302.00 328.00 3 2.5277e-01 1.3082e-04 1.6642e-02 -6.0000e+00 1.5035e-02 2.8544e-03 1.4527e-04 9.6490e-03 -6.0000e+00 1.6278e-02 1.0960e-03 8.2995e-05 4.6858e-03 -6.0000e+00 9.7315e-03 -6.2428e-03 3.5672e-05 1.3045e-03 -6.0000e+00 4.0592e-03 8.7340e-02 -1.0344e-04 3.0001e-06 1.9530e-05 -6.0000e+00 3.1119e-04 5.3469e-03 -2.1801e-06 11 8 0 10 0 0 58.87 22.63 0.46 0.00535 0.00457 3348 545 1 5 0 15.410 25.58 20.01 22.63 35.25 4.9 1054.51 636 196 -916 -2223 -2861 -2061 -1113 -72 -37 -1470 -2302 -1822 -938 -204 519 304 319 854 1398 1390 1323 1217 1622 1428 1296 1080 148 -534 -190 267 574 1186 492 -1421 -3005 -2964 -2452 -1376 -269 -522 -749 -409 -299 -167 -6 106 -206 -441 -452 40 480 824 1037 1041 767 865 734 284 232 566 1112 1641 1875 1408 565 -260 -560 -228 574 1131 654 695 611 417 -28 -779 -1376 -1666 -1675 -1560 -1784 -1936 -2009 -1711 -845 -472 200 558 475 427 366 -42 -403 -148 -75 92 475 556 124 -303 -909 -1309 -822 -491 -863 -938 -541 -289 408 790 797 582 390 82 -85 -36 136 393 463 364 368 523 561 628 683 317 256 383 336 126 -144 -388 -209 41 92 100 353 243 45 -31 -457 -884 -1005 205 64 -309 -777 -913 -615 -337 -23 -13 -519 -823 -657 -361 -87 228 146 149 409 686 700 678 624 839 767 683 586 80 -296 -98 133 291 630 278 -784 -1620 -1669 -1383 -830 -179 -381 -571 -326 -245 -137 -5 86 -164 -341 -357 31 368 665 838 878 667 765 657 255 206 500 1007 1502 1756 1383 553 -250 -500 -206 515 1068 647 719 635 420 -27 -732 -1236 -1423 -1470 -1436 -1749 -1996 -2126 -1904 -958 -548 243 673 574 515 425 -47 -427 -151 -79 102 555 682 154 -373 -1102 -1545 -931 -571 -1040 -1157 -696 -375 549 1079 1128 825 531 107 -106 -44 166 498 604 488 506 714 748 828 885 393 316 475 421 161 -192 -515 -282 57 131 145 524 369 68 -46 -666 -1298 -1463 SS 20240912T153551.5Z 9021.649902 17 1 51.62 2 40.51 145.69 137.12 91.96 0.00 1 0.00 1 0 17 9.965e-03 7.760e-03 1.353e-04 9.363e-05 1.857535e-01 5.005813e-05 2.213467e-03 -6.000000e+00 6.001298e-03 229.46 -2.00 3.48 -2.00 314.91 0.00e+00 6.101424e-04 4.368185e-06 6.902350e-05 -6.000000e+00 2.716427e-04 289.13 -2.00 20.00 -2.00 314.23 0.00e+00 1.314 0.000 302.00 328.00 3 2.6545e-01 1.2847e-04 1.6212e-02 -6.0000e+00 1.4917e-02 4.2275e-03 1.4270e-04 9.4247e-03 -6.0000e+00 1.6148e-02 8.2471e-04 8.1439e-05 4.5790e-03 -6.0000e+00 9.6541e-03 -6.0954e-03 3.4981e-05 1.2755e-03 -6.0000e+00 4.0288e-03 9.0153e-02 -1.1553e-04 2.9462e-06 1.9175e-05 -6.0000e+00 3.0863e-04 2.7008e-03 3.0715e-06 11 8 0 10 0 0 63.81 23.42 0.46 0.00270 0.00183 3465 564 1 5 0 14.890 26.11 20.00 23.42 34.65 4.9 1051.10 557 258 -917 -2115 -2828 -2014 -1092 -31 28 -1435 -2271 -1796 -904 -229 520 240 292 814 1382 1418 1330 1242 1563 1420 1282 1132 205 -509 -199 270 576 1154 556 -1370 -2986 -2952 -2458 -1431 -278 -519 -762 -406 -323 -198 -50 66 -216 -442 -456 15 452 809 1027 1028 761 875 743 305 221 556 1115 1611 1879 1421 563 -246 -566 -244 566 1120 656 665 606 422 -13 -750 -1355 -1658 -1643 -1529 -1761 -1940 -1981 -1719 -862 -476 189 553 470 421 374 -19 -396 -156 -54 101 478 554 137 -296 -900 -1307 -818 -448 -849 -953 -538 -308 387 793 828 594 416 86 -83 -34 131 409 478 379 372 516 562 623 664 321 257 390 338 138 -142 -366 -219 51 95 102 344 237 47 -37 -456 -873 -1005 188 88 -322 -715 -940 -625 -343 -11 10 -526 -842 -670 -358 -94 236 111 140 400 696 732 699 653 828 780 691 627 114 -271 -105 137 298 624 300 -767 -1636 -1687 -1404 -874 -187 -383 -588 -328 -267 -157 -42 54 -175 -346 -347 12 349 657 834 871 665 777 668 275 197 493 1013 1480 1764 1400 553 -237 -507 -221 507 1054 648 687 630 425 -13 -706 -1218 -1414 -1435 -1399 -1716 -1987 -2167 -1902 -971 -551 229 687 585 506 433 -21 -418 -165 -56 111 553 673 169 -374 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