File name: Pandora75s1_EssexMD_20240515_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250117T132444.3Z 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_20240515_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: 20240515 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 20240515T155345.3Z 8901.662330 285 1 9.27 2 25.06 138.89 98.87 61.64 0.00 1 0.00 1 0 17 9.829e-03 7.978e-03 1.608e-03 1.182e-03 1.702414e-01 6.404077e-04 2.018295e-03 -6.000000e+00 5.960165e-03 231.25 -2.00 3.48 -2.00 314.56 0.00e+00 6.787081e-04 5.100871e-05 4.417131e-05 -6.000000e+00 2.630744e-04 284.71 -2.00 20.00 -2.00 313.98 0.00e+00 1.104 0.000 302.00 328.00 3 3.7567e+00 1.6454e-03 1.4148e-02 -6.0000e+00 1.4904e-02 3.4616e-02 1.8200e-03 8.7073e-03 -6.0000e+00 1.6121e-02 -3.0512e-03 1.0390e-03 4.2014e-03 -6.0000e+00 9.5975e-03 -5.1437e-03 4.3946e-04 1.1831e-03 -6.0000e+00 3.9746e-03 3.4297e-03 2.0495e-04 3.7082e-05 1.7817e-05 -6.0000e+00 3.0445e-04 8.5393e-05 5.4401e-05 12 9 1 12 1 1 99.77 23.53 0.57 0.00009 0.00163 18 17 1 5 0 487.380 26.32 19.99 23.53 24.59 4.2 998.58 676 -120 432 -2017 -2358 -2013 6 -51 215 -1239 -2074 -1659 -1318 -158 524 445 82 1121 1154 903 1211 1171 1750 1139 1324 1126 156 -570 -129 -45 358 1205 691 -1386 -2984 -2950 -2829 -1441 -484 -579 -744 -149 -202 -293 -293 22 -213 -443 -431 -122 431 657 979 1206 890 716 613 217 421 617 1015 1673 1937 1374 514 -211 -506 -454 563 1035 811 872 685 224 162 -805 -1286 -1471 -1887 -1352 -1748 -1899 -1983 -1806 -969 -397 397 534 664 391 223 -68 -407 -347 -64 105 448 738 215 -218 -747 -1220 -856 -634 -881 -905 -534 -237 309 829 958 650 541 -11 -316 -132 -20 252 391 469 375 673 366 681 747 377 136 275 149 116 -181 -382 -215 15 237 127 338 344 93 -55 -441 -926 -1024 254 -46 166 -812 -862 -687 2 -19 86 -492 -830 -665 -561 -74 251 231 44 613 648 488 662 639 957 647 778 680 94 -330 -74 -25 199 697 395 -822 -1727 -1671 -1703 -918 -338 -441 -590 -123 -171 -250 -250 19 -175 -371 -349 -98 352 535 832 1066 810 631 546 194 388 567 911 1579 1857 1380 514 -207 -460 -418 508 1023 834 897 710 236 160 -762 -1164 -1323 -1651 -1285 -1757 -1991 -2121 -2031 -1104 -461 482 668 830 472 261 -76 -436 -356 -67 115 513 881 269 -271 -882 -1410 -991 -722 -1077 -1125 -665 -308 415 1119 1335 906 723 -15 -392 -161 -25 316 501 615 506 902 480 886 921 461 160 323 183 143 -234 -506 -278 20 320 181 492 494 135 -78 -632 -1297 -1420 SS 20240515T165355.0Z 8901.704108 325 1 51.93 2 20.29 174.28 88.66 71.30 0.00 1 0.00 1 0 17 1.076e-02 8.916e-03 1.926e-03 1.298e-03 1.713667e-01 6.996043e-04 2.020724e-03 -6.000000e+00 6.524054e-03 231.25 -2.00 3.48 -2.00 314.98 0.00e+00 6.276128e-04 5.999268e-05 7.360311e-05 -6.000000e+00 2.879685e-04 284.72 -2.00 20.00 -2.00 314.34 0.00e+00 1.066 0.000 302.00 328.00 3 5.6032e+00 1.8047e-03 1.3881e-02 -6.0000e+00 1.6314e-02 4.8251e-02 2.0004e-03 8.7057e-03 -6.0000e+00 1.7647e-02 -4.9658e-03 1.1398e-03 4.2127e-03 -6.0000e+00 1.0506e-02 -3.4858e-03 4.8805e-04 1.1743e-03 -6.0000e+00 4.3505e-03 5.5710e-04 1.0732e-04 4.0919e-05 1.7026e-05 -6.0000e+00 3.3328e-04 1.3156e-04 4.3519e-05 11 8 0 10 0 0 99.57 23.53 0.64 0.00013 0.00094 30 5 1 5 0 1730.820 26.21 19.99 23.53 25.55 4.1 1003.28 51 402 664 -489 -2128 -2155 -1130 107 -1417 -1359 -3049 -1539 -1529 411 403 88 383 676 743 681 1653 916 900 1485 899 1438 -248 -743 -469 1274 28 298 712 -1464 -3081 -2873 -2785 -2228 181 38 -690 163 23 151 -178 237 -444 -408 -695 34 200 647 812 1552 1219 917 573 -54 226 400 996 1822 2034 1319 567 -471 -726 -753 575 1258 774 1085 680 910 -214 -951 -1672 -2062 -2155 -2267 -1768 -2147 -2155 -1511 -784 -475 356 967 871 755 266 -42 -620 -847 -562 -67 423 690 500 200 -834 -1239 -1087 -742 -1149 -1261 -671 -44 573 1095 1377 742 412 -139 -623 52 -378 -33 576 593 456 587 689 611 561 236 144 408 250 227 -299 -407 -356 36 166 0 458 548 -4 211 -570 -960 -1167 16 136 229 -162 -647 -613 -324 33 -481 -484 -1104 -551 -584 170 170 40 181 326 367 345 840 468 464 785 496 807 -141 -402 -236 605 14 152 379 -809 -1661 -1512 -1558 -1304 121 28 -544 133 20 128 -151 197 -363 -322 -532 25 155 523 686 1354 1095 783 495 -47 207 365 866 1664 1977 1345 575 -448 -641 -686 538 1199 806 1105 698 963 -215 -870 -1496 -1745 -1860 -2139 -1713 -2279 -2285 -1676 -920 -558 436 1216 1097 918 321 -46 -670 -879 -600 -73 499 830 630 249 -992 -1470 -1241 -868 -1359 -1580 -874 -59 758 1509 1957 1059 565 -188 -778 65 -468 -40 739 808 605 773 937 796 693 295 173 487 312 280 -387 -538 -479 49 228 0 677 826 -6 313 -829 -1364 -1642 SS 20240515T184340.8Z 8901.780333 390 1 51.13 2 29.76 234.58 68.62 87.86 0.00 1 0.00 1 0 17 1.007e-02 8.053e-03 1.451e-03 9.707e-04 1.796084e-01 5.216518e-04 2.112750e-03 -6.000000e+00 6.104424e-03 231.26 -2.00 3.48 -2.00 315.06 0.00e+00 6.868332e-04 4.560971e-05 6.341286e-05 -6.000000e+00 2.694413e-04 284.73 -2.00 20.00 -2.00 314.41 0.00e+00 1.151 0.000 302.00 328.00 3 4.9538e+00 1.3467e-03 1.4811e-02 -6.0000e+00 1.5265e-02 3.7488e-02 1.4944e-03 9.1437e-03 -6.0000e+00 1.6511e-02 -2.7869e-03 8.5107e-04 4.4203e-03 -6.0000e+00 9.8297e-03 -5.5562e-03 3.6392e-04 1.2426e-03 -6.0000e+00 4.0710e-03 9.6750e-04 1.6825e-04 3.0505e-05 1.8010e-05 -6.0000e+00 3.1181e-04 -6.4184e-04 3.8214e-05 11 9 0 11 8 0 99.98 23.56 0.43 -0.00064 0.00062 52 8 1 5 0 983.160 26.32 19.98 23.56 27.03 4.1 1014.36 117 822 135 -1399 -2678 -1968 -498 -627 -297 -1516 -2039 -2031 -1410 -73 47 366 -228 711 1008 963 1211 1778 1315 1229 1250 1236 -84 -781 -536 785 613 419 627 -1376 -2769 -2895 -2640 -1438 -218 -146 -565 157 -120 -282 -296 1 -175 -409 -411 19 534 522 1226 1368 943 1234 763 332 89 425 794 1637 1967 1476 649 -518 -755 -555 450 1024 664 975 709 474 2 -779 -1491 -1840 -1969 -1870 -1862 -2081 -2126 -1603 -778 -446 241 686 664 653 398 -38 -564 -573 -485 99 587 594 576 -109 -838 -1302 -753 -671 -853 -982 -537 -195 384 958 940 644 398 -57 -375 37 -54 289 521 439 466 628 554 496 421 364 263 310 284 253 -218 -414 -291 -26 14 83 330 321 -7 -58 -384 -755 -896 37 276 46 -465 -817 -559 -142 -194 -100 -543 -736 -738 -499 -28 20 170 -111 352 471 461 588 857 643 621 656 665 -45 -405 -281 391 311 224 324 -738 -1448 -1484 -1437 -882 -144 -104 -441 127 -100 -238 -249 1 -142 -322 -313 15 411 423 1036 1128 802 1062 667 291 77 367 701 1520 1829 1439 631 -504 -681 -482 403 1004 669 1025 751 487 2 -731 -1362 -1591 -1741 -1693 -1867 -2150 -2342 -1748 -897 -518 292 856 830 786 471 -41 -597 -581 -507 112 685 715 724 -136 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