File name: Pandora75s1_EssexMD_20240725_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250116T080021.7Z 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_20240725_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: 20240725 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 20240725T132643.2Z 8972.560222 290 1 51.84 2 52.10 95.27 75.95 255.74 0.00 1 0.00 1 0 17 1.105e-02 7.618e-03 1.400e-03 7.317e-04 2.225144e-01 3.918317e-04 2.607864e-03 -6.000000e+00 6.725644e-03 232.40 -2.00 3.48 -2.00 315.98 0.00e+00 6.470344e-04 4.227903e-05 1.561064e-04 -6.000000e+00 3.032150e-04 290.72 -2.00 20.00 -2.00 315.16 0.00e+00 1.624 0.000 302.00 328.00 3 3.9046e+00 1.0239e-03 1.9938e-02 -6.0000e+00 1.6831e-02 -2.5607e-04 1.1403e-03 1.1399e-02 -6.0000e+00 1.8174e-02 -5.1147e-04 6.5031e-04 5.4863e-03 -6.0000e+00 1.0849e-02 -7.0369e-03 2.8947e-04 1.4912e-03 -6.0000e+00 4.5077e-03 1.6320e-03 1.4273e-04 2.3187e-05 2.0780e-05 -6.0000e+00 3.4250e-04 4.5105e-03 4.9874e-05 11 8 0 10 0 0 99.71 23.67 0.59 0.00451 0.00558 98 16 1 5 0 528.950 26.41 20.00 23.67 35.97 4.5 1064.02 -625 93 -504 -2612 -3142 -3087 -1196 -557 -1094 -1775 -2856 -2733 -1736 -591 -201 -35 54 724 1097 1011 1760 1767 1501 1374 1389 1372 229 -988 -171 614 660 772 921 -1862 -3062 -3135 -2613 -1617 -243 -173 -768 -203 -182 -228 -80 282 -226 -417 -445 100 505 549 1121 1191 870 837 709 274 103 427 1101 1784 1894 1564 553 -446 -507 -157 601 1129 741 827 626 347 16 -938 -1261 -1751 -1745 -1648 -1768 -1796 -2080 -1549 -866 -390 298 734 542 537 363 -7 -417 -235 -288 -35 482 546 148 -365 -987 -1382 -853 -526 -971 -953 -624 -166 385 797 984 627 391 52 -190 117 131 278 482 289 460 388 544 516 640 114 214 374 300 159 -112 -333 -259 -19 97 73 267 311 122 128 -540 -764 -921 -126 20 -114 -576 -635 -590 -231 -117 -253 -436 -717 -699 -478 -181 -63 -12 20 269 421 400 704 708 613 584 617 580 97 -441 -71 247 274 340 431 -846 -1360 -1488 -1221 -859 -140 -107 -525 -145 -134 -170 -59 208 -164 -295 -308 69 360 416 834 928 701 688 591 229 85 352 930 1500 1708 1485 527 -402 -426 -136 512 1058 717 836 637 342 16 -841 -1098 -1459 -1501 -1470 -1660 -1850 -2177 -1704 -960 -459 367 885 655 656 413 -8 -449 -244 -313 -40 564 664 189 -463 -1252 -1644 -1022 -614 -1219 -1206 -826 -218 529 1152 1413 906 568 71 -251 146 171 360 665 404 658 551 753 717 843 144 273 479 386 217 -153 -468 -373 -29 146 115 414 492 193 198 -856 -1177 -1408 SS 20240725T133155.7Z 8972.563839 293 1 23.33 2 51.09 96.17 76.88 256.62 0.00 1 0.00 1 0 17 1.089e-02 7.752e-03 1.909e-03 1.084e-03 2.182121e-01 5.812244e-04 2.565002e-03 -6.000000e+00 6.631425e-03 232.40 -2.00 3.48 -2.00 315.78 0.00e+00 7.339172e-04 5.936446e-05 1.344738e-04 -6.000000e+00 2.989656e-04 290.72 -2.00 20.00 -2.00 314.97 0.00e+00 1.589 0.000 302.00 328.00 3 3.9301e+00 1.5128e-03 1.9524e-02 -6.0000e+00 1.6595e-02 2.1759e-03 1.6830e-03 1.1184e-02 -6.0000e+00 1.7919e-02 -2.2200e-03 9.5946e-04 5.3790e-03 -6.0000e+00 1.0697e-02 -5.9761e-03 4.2167e-04 1.4749e-03 -6.0000e+00 4.4446e-03 1.6576e-03 2.1240e-04 3.4276e-05 2.0538e-05 -6.0000e+00 3.3770e-04 4.5536e-03 5.6144e-05 12 9 1 12 1 1 99.55 23.67 0.44 0.00455 0.00615 30 11 1 5 0 752.640 26.41 20.01 23.67 36.13 4.5 1064.46 -873 367 257 -1852 -3977 -2954 -728 -1137 -847 -1816 -2538 -1854 -2069 309 517 22 371 694 956 1671 1640 1890 1229 1359 1248 1377 -112 -1096 -335 556 597 535 606 -1862 -2920 -3173 -2380 -1198 -114 -481 -703 -76 -91 -316 129 220 -191 -433 -553 14 440 367 1080 1011 1151 962 661 256 70 672 808 1847 1968 1757 701 -538 -291 -365 662 1067 801 991 789 302 -21 -943 -1176 -1895 -1872 -1621 -1614 -1738 -1908 -1638 -752 -550 147 634 490 619 343 67 -398 -101 -228 127 367 387 127 -362 -1013 -1372 -913 -613 -900 -999 -576 -187 516 808 997 659 344 109 -30 10 217 275 485 369 348 442 545 464 589 210 218 455 301 192 -182 -310 -288 -77 68 56 399 351 20 79 -435 -914 -862 -204 93 67 -467 -934 -649 -161 -275 -224 -512 -727 -538 -599 98 184 8 141 271 385 688 688 792 526 604 580 658 -54 -510 -146 233 258 246 295 -882 -1454 -1562 -1156 -660 -68 -314 -504 -54 -66 -232 94 160 -137 -321 -401 10 328 273 842 825 914 780 544 211 57 546 676 1627 1761 1651 661 -481 -255 -312 588 989 770 995 796 296 -20 -881 -1004 -1642 -1580 -1505 -1579 -1773 -2085 -1795 -873 -650 181 767 595 756 390 73 -423 -103 -244 141 429 472 162 -459 -1280 -1624 -1086 -715 -1125 -1267 -763 -248 712 1125 1440 957 482 149 -40 12 280 355 639 516 499 629 756 616 775 263 275 578 385 260 -248 -435 -414 -110 102 85 621 557 33 123 -662 -1413 -1319 SS 20240725T134138.4Z 8972.570583 299 1 51.59 2 49.23 97.90 78.63 258.23 0.00 1 0.00 1 0 17 1.046e-02 7.772e-03 3.397e-04 2.108e-04 2.096590e-01 1.133007e-04 2.463006e-03 -6.000000e+00 6.369743e-03 232.40 -2.00 3.48 -2.00 315.43 0.00e+00 6.663188e-04 1.088396e-05 1.030670e-04 -6.000000e+00 2.871786e-04 290.72 -2.00 20.00 -2.00 314.66 0.00e+00 1.528 0.000 302.00 328.00 3 1.6111e+00 2.9401e-04 1.8773e-02 -6.0000e+00 1.5940e-02 -2.0603e-03 3.2658e-04 1.0742e-02 -6.0000e+00 1.7213e-02 -1.7646e-03 1.8594e-04 5.1670e-03 -6.0000e+00 1.0275e-02 -5.6571e-03 8.0738e-05 1.4148e-03 -6.0000e+00 4.2690e-03 1.8194e-02 9.5481e-05 6.6304e-06 2.0104e-05 -6.0000e+00 3.2439e-04 4.6452e-03 4.3364e-05 11 8 0 10 0 0 98.20 23.67 0.47 0.00465 0.00536 732 119 1 5 0 70.470 26.41 20.00 23.67 36.39 4.5 1066.41 447 135 -763 -2077 -2923 -2354 -1285 -297 -302 -1601 -2696 -2194 -1176 -333 417 194 336 840 1337 1459 1516 1226 1670 1465 1404 1202 229 -472 -214 183 525 1141 506 -1452 -3141 -3134 -2498 -1545 -289 -504 -707 -409 -297 -180 -31 102 -269 -484 -540 6 425 760 1042 1039 788 877 755 289 186 581 1105 1681 1958 1508 617 -236 -520 -185 623 1162 759 781 665 445 3 -833 -1441 -1749 -1746 -1607 -1806 -1945 -1968 -1656 -789 -407 287 635 578 511 424 9 -397 -187 -98 55 431 551 87 -350 -958 -1370 -859 -495 -860 -966 -520 -288 425 809 797 576 370 47 -91 -71 155 427 475 401 384 522 554 593 604 283 182 378 323 92 -180 -415 -221 62 145 107 373 277 48 -9 -431 -858 -971 124 38 -220 -579 -810 -613 -340 -85 -87 -494 -848 -698 -401 -117 163 83 140 361 591 663 701 569 783 715 671 592 114 -240 -102 84 247 566 251 -750 -1592 -1564 -1327 -878 -181 -345 -505 -306 -228 -140 -24 79 -203 -356 -408 5 313 591 851 845 663 750 654 251 160 498 972 1492 1777 1440 589 -222 -457 -166 553 1083 741 798 682 442 3 -777 -1289 -1492 -1535 -1482 -1775 -2009 -2086 -1847 -896 -474 349 766 698 617 494 10 -426 -193 -106 62 513 689 110 -439 -1186 -1593 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