File name: Pandora75s1_EssexMD_20240528_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250116T072739.0Z 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_20240528_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: 20240528 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 20240528T135903.7Z 8914.582682 7 1 51.60 2 42.91 100.49 88.11 238.03 0.00 1 0.00 1 0 17 1.062e-02 7.942e-03 1.921e-04 1.207e-04 2.133806e-01 6.480420e-05 2.506324e-03 -6.000000e+00 6.449613e-03 231.96 -2.00 3.48 -2.00 315.37 0.00e+00 6.629665e-04 6.045364e-06 9.412134e-05 -6.000000e+00 2.855814e-04 285.97 -2.00 20.00 -2.00 314.68 0.00e+00 1.364 0.000 302.00 328.00 3 6.4554e-01 1.6793e-04 1.7584e-02 -6.0000e+00 1.6149e-02 2.9021e-04 1.8644e-04 1.0871e-02 -6.0000e+00 1.7460e-02 1.2533e-04 1.0627e-04 5.2507e-03 -6.0000e+00 1.0396e-02 -6.0127e-03 4.5962e-05 1.4454e-03 -6.0000e+00 4.3001e-03 5.5358e-02 -2.2825e-05 3.8049e-06 2.0958e-05 -6.0000e+00 3.2901e-04 5.2654e-03 -4.1266e-06 11 8 0 10 0 0 85.44 21.66 0.46 0.00527 0.00509 2302 375 1 5 0 22.410 24.56 20.01 21.66 33.50 4.1 1056.34 473 138 -949 -2312 -3106 -2426 -1432 -376 -318 -1756 -2613 -2226 -1146 -358 536 251 303 884 1449 1496 1426 1293 1590 1476 1376 1203 190 -522 -217 214 530 1184 541 -1368 -3115 -3068 -2519 -1433 -243 -456 -702 -391 -232 -117 59 173 -162 -424 -478 2 502 906 1078 1101 824 881 762 280 206 551 1120 1665 1982 1513 613 -251 -612 -298 554 1126 717 729 654 445 -8 -819 -1409 -1786 -1754 -1597 -1802 -1924 -2050 -1708 -858 -476 237 575 536 458 361 -93 -534 -288 -175 81 481 615 170 -255 -913 -1339 -868 -481 -816 -952 -533 -305 416 823 839 625 374 39 -169 -104 92 394 501 440 438 595 648 666 696 297 185 322 305 109 -169 -412 -269 -4 88 118 404 305 107 0 -453 -914 -1046 124 39 -280 -660 -881 -646 -388 -110 -94 -556 -840 -726 -401 -130 216 103 131 391 658 699 678 617 767 695 676 609 97 -255 -106 101 257 568 276 -728 -1626 -1578 -1380 -839 -157 -321 -517 -301 -175 -89 44 136 -125 -321 -353 2 381 724 863 922 680 741 649 239 174 464 966 1520 1848 1423 576 -232 -553 -262 505 1081 720 735 662 454 -8 -748 -1232 -1562 -1510 -1512 -1741 -1958 -2231 -1880 -962 -567 286 711 662 546 415 -102 -562 -305 -185 89 564 758 213 -327 -1112 -1588 -1024 -561 -985 -1218 -688 -410 564 1132 1198 896 516 52 -215 -130 114 508 666 598 610 824 874 889 913 372 232 406 389 142 -231 -560 -373 -6 129 175 617 460 162 0 -676 -1374 -1558 SS 20240528T140454.5Z 8914.586742 10 1 51.61 2 41.80 101.66 89.03 238.95 0.00 1 0.00 1 0 17 1.052e-02 7.921e-03 1.886e-04 1.204e-04 2.103660e-01 6.479649e-05 2.474320e-03 -6.000000e+00 6.390558e-03 231.96 -2.00 3.48 -2.00 315.30 0.00e+00 6.525840e-04 5.930890e-06 9.230548e-05 -6.000000e+00 2.828958e-04 285.97 -2.00 20.00 -2.00 314.61 0.00e+00 1.340 0.000 302.00 328.00 3 6.7456e-01 1.6776e-04 1.7305e-02 -6.0000e+00 1.6001e-02 7.5100e-04 1.8607e-04 1.0724e-02 -6.0000e+00 1.7298e-02 -5.4532e-04 1.0603e-04 5.1839e-03 -6.0000e+00 1.0300e-02 -5.7319e-03 4.5823e-05 1.4293e-03 -6.0000e+00 4.2620e-03 5.5345e-02 -2.8556e-05 3.7915e-06 2.0821e-05 -6.0000e+00 3.2589e-04 3.1301e-03 5.7982e-06 11 8 0 10 0 0 88.77 22.25 0.45 0.00313 0.00292 2211 360 1 5 0 23.340 25.28 19.99 22.25 33.78 4.1 1057.25 479 244 -826 -2131 -3063 -2343 -1424 -368 -229 -1707 -2552 -2185 -1100 -381 513 336 360 891 1462 1497 1405 1290 1643 1508 1356 1165 212 -512 -223 172 537 1138 607 -1402 -3027 -3109 -2539 -1478 -227 -450 -692 -357 -228 -99 42 191 -151 -400 -483 -11 485 874 1068 1071 776 867 771 294 200 526 1111 1637 1963 1507 625 -238 -600 -320 535 1146 707 757 661 468 -5 -773 -1399 -1753 -1771 -1627 -1795 -1935 -2012 -1744 -869 -475 216 622 508 463 358 -90 -536 -309 -161 51 467 610 175 -259 -895 -1338 -903 -476 -844 -945 -554 -310 398 804 851 622 408 55 -148 -85 82 399 482 423 451 590 620 664 677 287 143 304 283 102 -163 -414 -283 10 76 122 369 290 103 -2 -450 -909 -1056 130 72 -254 -632 -835 -648 -400 -103 -70 -560 -850 -738 -397 -142 213 142 160 406 684 720 645 594 764 729 685 607 111 -258 -105 83 267 558 317 -763 -1615 -1634 -1419 -882 -149 -324 -519 -267 -175 -76 32 146 -114 -308 -364 -8 374 676 869 870 651 740 666 255 171 449 972 1449 1856 1436 596 -224 -526 -284 472 1111 718 772 677 464 -5 -715 -1239 -1551 -1539 -1486 -1749 -1986 -2122 -1936 -984 -550 263 775 634 557 415 -100 -570 -317 -171 57 551 756 220 -323 -1099 -1599 -1034 -558 -1024 -1174 -719 -406 542 1112 1221 869 566 74 -190 -107 102 516 643 578 632 821 841 892 863 362 180 371 362 133 -216 -565 -394 14 112 182 564 440 157 -3 -674 -1328 -1529 SS 20240528T141021.1Z 8914.590522 13 1 51.65 2 40.77 102.77 89.89 239.81 0.00 1 0.00 1 0 17 1.043e-02 7.912e-03 1.820e-04 1.177e-04 2.067444e-01 6.342792e-05 2.433113e-03 -6.000000e+00 6.338694e-03 231.96 -2.00 3.48 -2.00 315.24 0.00e+00 6.438104e-04 5.739375e-06 8.769037e-05 -6.000000e+00 2.805689e-04 285.97 -2.00 20.00 -2.00 314.56 0.00e+00 1.319 0.000 302.00 328.00 3 6.5308e-01 1.6400e-04 1.7024e-02 -6.0000e+00 1.5871e-02 6.4547e-04 1.8184e-04 1.0541e-02 -6.0000e+00 1.7157e-02 -1.1213e-04 1.0375e-04 5.0956e-03 -6.0000e+00 1.0216e-02 -5.8614e-03 4.4692e-05 1.4053e-03 -6.0000e+00 4.2281e-03 5.8106e-02 -2.8619e-05 3.7127e-06 2.0653e-05 -6.0000e+00 3.2317e-04 1.8403e-03 9.5193e-06 11 8 0 10 0 0 88.45 22.59 0.45 0.00184 0.00163 2357 384 1 5 0 21.890 25.58 20.01 22.59 33.97 4.1 1058.31 547 161 -786 -2117 -2945 -2277 -1438 -242 -109 -1620 -2594 -2151 -1118 -303 489 237 365 889 1448 1498 1432 1278 1621 1492 1341 1228 215 -497 -206 180 544 1136 600 -1348 -3028 -3068 -2559 -1447 -229 -479 -697 -347 -255 -135 10 159 -145 -426 -481 8 473 858 1031 1080 787 868 763 303 203 515 1083 1615 1981 1520 620 -238 -598 -337 494 1157 710 734 696 455 42 -765 -1378 -1743 -1751 -1577 -1783 -1906 -2031 -1730 -878 -456 230 581 526 434 363 -85 -519 -287 -172 59 465 617 192 -258 -895 -1341 -899 -464 -819 -954 -543 -320 392 835 846 640 424 65 -158 -107 78 400 486 411 447 592 634 658 692 289 170 292 310 121 -164 -408 -281 -1 76 106 369 287 121 6 -452 -883 -1043 152 49 -247 -644 -822 -645 -414 -69 -34 -542 -884 -741 -411 -115 206 102 165 411 687 731 667 597 764 731 686 647 114 -253 -98 88 273 562 316 -739 -1628 -1623 -1439 -867 -151 -346 -526 -261 -197 -106 8 123 -109 -330 -363 6 365 665 839 919 660 741 659 262 174 440 947 1428 1870 1446 590 -223 -547 -298 454 1116 717 745 710 469 41 -706 -1217 -1535 -1513 -1430 -1725 -1940 -2212 -1907 -986 -544 277 720 652 519 418 -93 -548 -304 -182 65 542 756 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