File name: Pandora75s1_EssexMD_20240821_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20240912T151537.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v104d20221230.txt Level 1 file used: Pandora75s1_EssexMD_20240821_L1_smca1c1d20221230p1-8.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: 20240821 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-data based on session 103 First and last pixel inside fitting window: 196 337 Nominal wavelengths inside fitting window [nm]: 305.0663 305.2078 305.3493 305.4908 305.6322 305.7737 305.9151 306.0566 306.1980 306.3394 306.4807 306.6221 306.7635 306.9048 307.0461 307.1874 307.3287 307.4700 307.6112 307.7524 307.8937 308.0349 308.1761 308.3172 308.4584 308.5996 308.7407 308.8818 309.0229 309.1640 309.3051 309.4461 309.5872 309.7282 309.8692 310.0102 310.1512 310.2921 310.4331 310.5740 310.7149 310.8558 310.9967 311.1376 311.2784 311.4193 311.5601 311.7009 311.8417 311.9825 312.1233 312.2640 312.4048 312.5455 312.6862 312.8269 312.9676 313.1083 313.2489 313.3896 313.5302 313.6708 313.8114 313.9520 314.0925 314.2331 314.3736 314.5141 314.6547 314.7951 314.9356 315.0761 315.2165 315.3570 315.4974 315.6378 315.7782 315.9186 316.0590 316.1993 316.3397 316.4800 316.6203 316.7606 316.9009 317.0411 317.1814 317.3216 317.4619 317.6021 317.7423 317.8825 318.0227 318.1628 318.3030 318.4431 318.5832 318.7233 318.8634 319.0035 319.1436 319.2836 319.4237 319.5637 319.7037 319.8437 319.9837 320.1237 320.2636 320.4036 320.5435 320.6834 320.8233 320.9632 321.1031 321.2430 321.3828 321.5227 321.6625 321.8023 321.9421 322.0819 322.2217 322.3615 322.5012 322.6409 322.7807 322.9204 323.0601 323.1998 323.3395 323.4791 323.6188 323.7584 323.8980 324.0376 324.1772 324.3168 324.4564 324.5960 324.7355 324.8750 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20240821T141551.1Z 8999.594342 5 1 10.29 2 47.07 113.60 110.31 282.13 0.00 1 0.00 1 0 17 1.086e-02 8.074e-03 9.460e-04 5.957e-04 2.157790e-01 3.250277e-04 2.610807e-03 -6.000000e+00 6.681757e-03 231.18 -2.00 3.48 -2.00 315.31 0.00e+00 5.525122e-04 3.019820e-05 1.162191e-04 -6.000000e+00 2.986738e-04 290.71 -2.00 20.00 -2.00 314.59 0.00e+00 1.466 0.000 302.00 328.00 3 1.8377e+00 8.3826e-04 1.8505e-02 -6.0000e+00 1.6679e-02 2.1287e-02 9.2529e-04 1.1117e-02 -6.0000e+00 1.7924e-02 -5.7908e-03 5.3046e-04 5.4027e-03 -6.0000e+00 1.0707e-02 -5.4573e-03 2.3728e-04 1.4913e-03 -6.0000e+00 4.5793e-03 1.5017e-02 -7.4327e-04 1.8615e-05 2.2331e-05 -6.0000e+00 3.3478e-04 -2.8805e-02 2.2639e-04 12 9 1 12 1 1 88.04 23.39 0.42 -0.02881 -0.03439 86 71 1 5 0 118.280 26.11 20.01 23.39 28.87 5.0 1016.53 -411 130 70 -1005 -2325 -2353 -1647 -1131 -926 -1701 -2347 -2468 -1767 -944 -79 472 516 1112 1721 1682 1728 1499 1652 1405 1203 1383 892 327 23 -70 280 722 403 -1139 -3059 -3475 -3232 -2211 -773 -601 -553 -231 -111 -30 99 303 51 -308 -574 -86 309 865 900 977 974 911 796 529 268 471 929 1520 1969 1450 669 -258 -547 -657 369 1175 851 846 689 447 41 -862 -1582 -1939 -1911 -1635 -1697 -1954 -1761 -1513 -835 -373 197 774 686 475 196 -155 -658 -363 -89 159 596 625 252 -231 -890 -1413 -886 -571 -810 -945 -451 -182 486 906 942 680 341 -4 -123 -121 158 438 629 488 384 380 548 572 425 132 109 276 311 148 -177 -373 -361 85 47 120 310 220 -57 -183 -642 -1120 -108 37 21 -288 -663 -630 -448 -334 -277 -542 -759 -810 -623 -344 -32 194 223 493 784 789 825 717 801 665 595 704 456 160 11 -33 137 349 207 -609 -1604 -1797 -1786 -1304 -501 -426 -408 -178 -84 -23 75 240 39 -233 -425 -63 235 693 724 821 806 768 680 451 226 397 803 1390 1839 1367 629 -239 -494 -579 338 1129 856 854 697 456 41 -785 -1382 -1696 -1727 -1550 -1712 -1992 -1913 -1663 -938 -445 237 953 845 564 224 -170 -691 -384 -94 176 699 771 325 -295 -1081 -1672 -1044 -666 -1014 -1208 -580 -244 658 1244 1341 971 484 -5 -161 -151 196 565 835 663 535 524 762 761 556 165 136 347 397 194 -242 -524 -502 122 69 178 473 342 -89 -279 -957 -1681 SS 20240821T142048.2Z 8999.597781 8 1 4.68 2 46.19 114.76 111.19 282.98 0.00 1 0.00 1 0 17 1.042e-02 7.732e-03 1.418e-03 8.991e-04 2.127555e-01 4.924730e-04 2.564293e-03 -6.000000e+00 6.413314e-03 231.18 -2.00 3.48 -2.00 315.27 0.00e+00 4.411177e-04 4.530210e-05 1.006635e-04 -6.000000e+00 2.866288e-04 290.71 -2.00 20.00 -2.00 314.55 0.00e+00 1.442 0.000 302.00 328.00 3 1.8848e+00 1.2706e-03 1.8216e-02 -6.0000e+00 1.6009e-02 2.4242e-02 1.4014e-03 1.0945e-02 -6.0000e+00 1.7203e-02 -6.1451e-03 8.0340e-04 5.3224e-03 -6.0000e+00 1.0276e-02 -5.3412e-03 3.5879e-04 1.4668e-03 -6.0000e+00 4.3961e-03 1.4732e-02 -7.1180e-04 2.8196e-05 2.1971e-05 -6.0000e+00 3.2125e-04 -3.0446e-02 2.2326e-04 12 9 1 12 1 1 99.67 23.47 0.41 -0.03045 -0.03580 40 74 1 5 0 113.970 26.21 20.01 23.47 29.26 5.0 1019.37 -812 384 -403 -410 -2261 -2407 -1666 -1455 -835 -1711 -1866 -2455 -1312 -1062 -19 97 486 731 1643 1697 1747 1592 1559 1745 1361 1108 761 204 -347 13 691 718 302 -1507 -2719 -3384 -2753 -1972 -702 -676 -517 -355 -143 -46 203 450 -155 -345 -700 -25 548 713 815 1062 982 899 812 343 327 397 842 1348 1837 1330 645 -259 -579 -611 335 1098 709 878 605 552 -68 -967 -1495 -1876 -1588 -1650 -1646 -1927 -1916 -1631 -782 -327 208 623 598 512 205 -25 -608 -254 -154 263 606 712 321 -152 -831 -1366 -881 -544 -613 -847 -621 -255 508 867 723 542 297 126 -133 39 79 360 494 312 370 552 513 410 536 153 177 410 276 34 -216 -313 -303 -17 96 153 296 240 -51 -279 -686 -981 -217 111 -121 -118 -653 -653 -458 -435 -252 -551 -607 -813 -463 -389 -8 40 211 326 750 797 835 761 756 879 673 566 390 100 -170 6 335 368 154 -804 -1412 -1736 -1503 -1151 -450 -475 -379 -273 -113 -36 161 353 -120 -258 -513 -19 411 565 647 880 839 783 716 303 285 346 752 1215 1691 1288 623 -246 -515 -529 301 1035 700 904 626 552 -67 -906 -1342 -1608 -1400 -1531 -1623 -2000 -2038 -1825 -891 -381 253 779 748 616 239 -28 -650 -263 -165 295 719 887 404 -189 -1020 -1635 -1012 -642 -746 -1053 -807 -333 692 1197 1038 780 410 168 -170 49 99 468 660 427 517 766 693 550 706 192 223 520 355 45 -296 -426 -422 -24 141 227 452 362 -77 -427 -1023 -1473 SS 20240821T142508.3Z 8999.600791 11 1 2.49 2 45.44 115.79 111.96 283.73 0.00 1 0.00 1 0 25 1.020e-02 7.863e-03 1.938e-03 1.237e-03 2.101822e-01 6.761466e-04 2.540942e-03 -6.000000e+00 6.280571e-03 231.18 -2.00 3.48 -2.00 315.24 0.00e+00 4.833594e-04 6.194073e-05 1.037645e-04 -6.000000e+00 2.806695e-04 290.71 -2.00 20.00 -2.00 314.52 0.00e+00 1.423 0.000 302.00 328.00 3 1.8877e+00 1.7433e-03 1.7987e-02 -6.0000e+00 1.5678e-02 2.5532e-02 1.9231e-03 1.0825e-02 -6.0000e+00 1.6846e-02 -6.4090e-03 1.1027e-03 5.2648e-03 -6.0000e+00 1.0063e-02 -4.9759e-03 4.9219e-04 1.4532e-03 -6.0000e+00 4.3056e-03 1.5030e-02 -7.5031e-04 3.8755e-05 2.1737e-05 -6.0000e+00 3.1455e-04 -3.1060e-02 2.3930e-04 12 9 1 12 1 1 99.59 23.53 0.41 -0.03106 -0.03670 22 78 1 5 0 107.900 26.32 19.99 23.53 29.60 4.9 1021.05 -78 288 137 -563 -2013 -1756 -1289 -524 -18 -1005 -1613 -2540 -1872 -1420 -365 292 875 312 1446 1867 1033 1480 1200 1779 585 1414 335 98 116 157 177 673 411 -1064 -2481 -3677 -3312 -2296 -669 -682 -217 -328 -374 -146 313 125 -137 -586 -514 168 161 653 701 1111 902 1192 907 369 399 468 916 1380 1939 1436 714 -113 -594 -161 393 1146 559 782 544 603 113 -839 -1583 -1757 -1716 -1519 -1819 -2006 -1949 -1698 -917 -427 245 572 741 565 113 -78 -529 -262 -30 -20 740 794 184 -333 -744 -1307 -750 -517 -573 -889 -610 -322 623 858 832 722 312 10 -165 -231 131 491 377 473 376 365 468 370 424 144 -47 443 276 18 -116 -201 -288 158 -11 295 364 122 -118 -132 -683 -1071 -21 85 42 -166 -590 -481 -359 -158 -5 -326 -531 -852 -672 -527 -150 122 382 141 667 882 501 714 589 902 293 724 173 48 57 75 86 346 210 -567 -1289 -1896 -1819 -1344 -429 -480 -159 -252 -295 -116 248 99 -105 -440 -395 128 121 516 583 916 769 1030 796 324 347 405 814 1238 1855 1382 685 -107 -525 -144 350 1072 572 800 560 625 110 -780 -1413 -1493 -1502 -1394 -1779 -2063 -2138 -1883 -1035 -512 295 709 917 674 131 -85 -560 -279 -32 -23 865 975 237 -425 -901 -1546 -884 -603 -715 -1133 -783 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