File name: Pandora75s1_EssexMD_20250925_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250926T050053.2Z 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 v1.8.75 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20250925_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: 20250925 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 20250925T183534.9Z 9399.774710 165 1 51.88 2 46.32 215.05 62.94 163.54 0.00 1 0.00 1 0 17 9.890e-03 7.439e-03 7.092e-04 4.190e-04 1.722060e-01 2.208493e-04 2.036293e-03 -6.000000e+00 5.927304e-03 228.25 -2.00 3.48 -2.00 315.60 0.00e+00 5.962402e-04 2.205506e-05 1.039843e-04 -6.000000e+00 2.680563e-04 287.79 -2.00 20.00 -2.00 314.86 0.00e+00 1.446 0.000 302.00 328.00 3 2.8759e+00 5.7037e-04 1.6826e-02 -6.0000e+00 1.4698e-02 1.4905e-02 6.3703e-04 8.6833e-03 -6.0000e+00 1.5930e-02 7.1646e-04 3.6334e-04 4.2169e-03 -6.0000e+00 9.5252e-03 -6.8443e-03 1.5889e-04 1.1806e-03 -6.0000e+00 3.9769e-03 6.0114e-03 2.1750e-04 1.3287e-05 1.6509e-05 -6.0000e+00 3.0618e-04 7.3446e-03 7.4650e-05 11 8 0 10 0 0 100.00 23.71 0.49 0.00734 0.00898 1348 219 1 5 0 38.280 26.41 20.00 23.71 34.44 7.4 1059.37 -64 -98 -745 -2019 -2792 -2094 -1245 -100 65 -1651 -2178 -1834 -839 -527 315 -46 309 612 1262 1177 1230 1233 1453 1401 1266 1104 101 -397 -164 398 569 1154 515 -1549 -2894 -3007 -2346 -1514 -257 -548 -769 -462 -288 -249 -75 135 -211 -428 -418 149 415 861 1027 1084 747 904 649 249 334 621 1217 1581 1925 1378 535 -236 -516 -249 628 1109 578 712 540 409 -2 -768 -1456 -1628 -1714 -1569 -1727 -1936 -1971 -1711 -810 -461 263 601 462 430 322 -67 -485 -170 -157 61 493 579 184 -246 -903 -1338 -758 -490 -831 -955 -531 -290 403 792 777 506 283 -39 -162 -65 76 373 456 370 366 515 542 569 675 264 240 298 376 134 -175 -419 -234 48 172 185 364 268 112 47 -498 -837 -966 -17 -27 -214 -556 -701 -492 -297 -26 18 -492 -652 -553 -268 -186 112 -18 123 248 523 500 530 531 631 630 592 531 49 -182 -70 164 238 503 237 -740 -1346 -1376 -1141 -835 -164 -371 -570 -357 -228 -198 -59 106 -162 -318 -301 106 304 661 826 908 645 731 531 204 293 543 1007 1384 1793 1344 518 -215 -435 -220 530 1028 585 752 574 420 -1 -678 -1273 -1350 -1459 -1461 -1646 -2018 -2033 -1856 -930 -563 314 737 566 544 379 -72 -518 -174 -167 65 578 737 229 -302 -1133 -1578 -859 -572 -1043 -1185 -687 -391 565 1158 1102 717 409 -53 -215 -82 95 486 592 510 520 726 745 749 902 336 294 367 484 181 -231 -568 -323 69 258 272 551 415 173 72 -743 -1300 -1490 SS 20250925T185437.1Z 9399.787929 171 1 51.74 2 48.58 220.73 62.12 168.34 0.00 1 0.00 1 0 17 9.900e-03 7.751e-03 1.619e-04 1.121e-04 1.794674e-01 5.954454e-05 2.139865e-03 -6.000000e+00 5.932892e-03 228.25 -2.00 3.48 -2.00 314.93 0.00e+00 6.086341e-04 5.177205e-06 6.598473e-05 -6.000000e+00 2.683251e-04 287.78 -2.00 20.00 -2.00 314.25 0.00e+00 1.509 0.000 302.00 328.00 3 4.5878e-01 1.5242e-04 1.7571e-02 -6.0000e+00 1.4711e-02 7.0836e-05 1.6951e-04 9.0892e-03 -6.0000e+00 1.5945e-02 5.6791e-04 9.6828e-05 4.4126e-03 -6.0000e+00 9.5344e-03 -5.7430e-03 4.1593e-05 1.2407e-03 -6.0000e+00 3.9804e-03 6.2802e-02 1.2055e-04 3.5326e-06 1.8486e-05 -6.0000e+00 3.0650e-04 7.6431e-03 6.3133e-05 11 8 0 10 0 0 98.63 23.71 0.47 0.00764 0.00855 2631 428 1 5 0 19.610 26.41 19.99 23.71 36.13 7.3 1067.74 621 193 -833 -2084 -2638 -1916 -983 3 -19 -1410 -2226 -1763 -904 -186 481 244 371 846 1423 1387 1342 1270 1564 1433 1342 1130 217 -400 -88 337 601 1204 496 -1449 -2924 -2926 -2412 -1407 -307 -574 -775 -435 -331 -204 -68 70 -230 -468 -444 36 454 832 1036 1039 784 899 768 307 263 582 1122 1653 1885 1387 542 -229 -555 -182 598 1118 679 704 637 423 -44 -787 -1377 -1647 -1694 -1585 -1775 -1927 -1995 -1674 -827 -455 234 579 492 442 356 -57 -408 -183 -98 123 467 536 107 -303 -924 -1304 -810 -458 -846 -920 -513 -282 419 799 804 563 379 47 -105 -41 132 412 498 392 395 525 547 611 640 286 266 371 330 134 -164 -378 -201 51 103 141 363 248 42 -42 -480 -886 -979 204 69 -305 -734 -847 -576 -300 1 -7 -539 -860 -686 -348 -79 211 116 184 428 689 689 678 642 798 758 739 640 123 -217 -45 175 318 624 273 -825 -1625 -1600 -1405 -874 -210 -428 -602 -352 -262 -163 -54 55 -186 -367 -338 27 352 678 843 882 686 798 659 264 234 518 977 1521 1769 1365 530 -220 -496 -164 536 1052 668 724 658 424 -43 -738 -1238 -1408 -1488 -1456 -1732 -1972 -2178 -1845 -928 -543 282 715 609 527 410 -62 -429 -193 -103 135 540 649 136 -380 -1103 -1519 -943 -528 -1010 -1163 -653 -375 558 1113 1119 785 524 63 -133 -52 165 516 641 518 537 708 746 798 822 350 325 456 410 175 -216 -511 -277 70 145 207 531 371 63 -62 -713 -1287 -1410 SS 20250925T194100.2Z 9399.820141 180 1 51.73 2 55.15 232.92 61.38 180.31 0.00 1 0.00 1 0 17 1.040e-02 7.695e-03 2.083e-04 1.270e-04 2.069937e-01 6.715974e-05 2.461523e-03 -6.000000e+00 6.234373e-03 228.24 -2.00 3.48 -2.00 315.50 0.00e+00 6.788895e-04 6.571764e-06 1.083772e-04 -6.000000e+00 2.819960e-04 287.78 -2.00 20.00 -2.00 314.78 0.00e+00 1.745 0.000 302.00 328.00 3 4.2310e-01 1.7300e-04 2.0300e-02 -6.0000e+00 1.5459e-02 -5.6612e-03 1.9278e-04 1.0474e-02 -6.0000e+00 1.6756e-02 1.6854e-03 1.0993e-04 5.0875e-03 -6.0000e+00 1.0019e-02 -6.0159e-03 4.8263e-05 1.4211e-03 -6.0000e+00 4.1823e-03 4.9174e-02 -2.9914e-05 3.9972e-06 2.0329e-05 -6.0000e+00 3.2214e-04 7.6677e-03 2.2160e-05 11 8 0 10 0 0 83.39 23.71 0.45 0.00767 0.00744 2385 388 1 5 0 21.630 26.41 20.00 23.71 38.19 7.2 1080.46 429 163 -891 -2246 -2980 -2361 -1397 -387 -378 -1797 -2653 -2113 -1153 -381 453 222 323 904 1391 1441 1425 1291 1606 1462 1324 1097 134 -568 -182 122 522 1183 475 -1464 -3032 -3042 -2453 -1367 -238 -468 -700 -361 -237 -145 13 149 -173 -405 -445 57 484 842 1037 1036 815 876 720 262 194 572 1159 1701 1941 1482 612 -164 -504 -163 660 1172 732 716 641 404 -61 -800 -1403 -1681 -1707 -1581 -1800 -1921 -1969 -1648 -796 -410 266 594 508 469 358 -77 -468 -233 -133 90 496 574 102 -331 -956 -1346 -872 -516 -859 -939 -544 -274 432 815 832 592 387 41 -112 -63 117 413 478 400 401 546 573 596 632 264 240 364 317 147 -162 -385 -187 47 73 105 370 243 44 -20 -471 -855 -947 113 47 -264 -642 -781 -582 -351 -105 -113 -527 -790 -638 -374 -138 169 91 138 396 626 622 626 569 716 679 642 549 68 -274 -82 57 234 560 240 -768 -1559 -1543 -1327 -787 -151 -323 -503 -272 -183 -107 10 115 -132 -299 -322 41 359 659 811 847 688 718 598 218 160 470 976 1518 1769 1420 586 -148 -445 -140 590 1100 717 734 660 403 -59 -750 -1206 -1449 -1519 -1475 -1786 -2000 -2099 -1775 -908 -479 324 718 614 567 420 -86 -485 -243 -139 102 572 695 130 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